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二叔丁基二碳酸酯

Di-tert butyl dicarbonate

CAS: 24424-99-5

Molecular Formula: C10H18O5

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二叔丁基二碳酸酯 - Names and Identifiers

Name Di-tert butyl dicarbonate
Synonyms BOC
(BOC)2O
(BOC)2O FLUKA
BOC ANHYDRIDE
RARECHEM TB OC 0001
tert-butyldicarbonate
Di-tert-butyl dicarbonate
Di-tert butyl dicarbonate
PYROCARBONIC ACID DI-TERT-BUTYL ESTER
CAS 24424-99-5
EINECS 246-240-1
InChI InChI=1/C10H18O5/c1-8(2,3)11-7(10)12-9(4,5)6/h1-6H3

二叔丁基二碳酸酯 - Physico-chemical Properties

Molecular FormulaC10H18O5
Molar Mass218.25
Density0.932g/cm3
Melting Point22-24℃
Boling Point185.342°C at 760 mmHg
Flash Point67.065°C
Water SolubilityMiscible with decalin, toluene, carbon tetrachloride, tetrahydrofuran, dioxane, alcohols, acetone, acetonitrile and dimethylformamide. Immiscible with water.
Vapor Presure0.7mmHg at 25°C
Refractive Index1.419
Physical and Chemical Properties

UsePharmaceutical and organic synthesis intermediates, is an important application in medicine and agrochemical products synthesis of amino protective agent

二叔丁基二碳酸酯 - Risk and Safety

Hazard SymbolsT+ - Very toxic
Very toxic
F+ - Highly flammable
Highly flammable
Xi - Irritant
Irritant
Risk CodesR10 - Flammable
R26 - Very Toxic by inhalation
R36/37/38 - Irritating to eyes, respiratory system and skin.
R43 - May cause sensitization by skin contact
Safety DescriptionS16 - Keep away from sources of ignition.
S24 - Avoid contact with skin.
S37/39 - Wear suitable gloves and eye/face protection
S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
UN IDs2929

二叔丁基二碳酸酯 - Upstream Downstream Industry

Raw MaterialsTetrahydrofuran
Carbon tetrachloride
CARBON DIOXIDE
Potassium tert-butoxide
1,8-Diazabicyclo[5.4.0]undec-7-ene
N-OCTANE
Downstream ProductsN-Boc-D-proline
BOC-L-Isoleucine
5-[N-(TERT-BUTOXYCARBONYL)AMINO]-2-CHLOROPYRIDINE
TERT-BUTYL 4-(5-FORMYL-4-METHYL-1,3-THIAZOL-2-YL)PIPERIDINE-1-CARBOXYLATE
1-Boc-4-cyanopiperidine
TERT-BUTYL 4-(4-FORMYL-1,3-THIAZOL-2-YL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
6-TERT-BUTOXYCARBONYLAMINO-PYRIDINE-2-CARBOXYLIC ACID
1-TERT-BUTYL 6-METHYL 3-FORMYL-1H-INDOLE-1,6-DICARBOXYLATE
(S)-N-Boc-allylglycine
TERT-BUTYL 3-FORMYLPYRIDIN-4-YLCARBAMATE
2-(2,2-DIMETHYL-PROPIONYLAMINO)-ISONICOTINIC ACID
1-Boc-piperazine acetate
Spermidine
TERT-BUTYL 3-(4-AMINO-2,6-DICHLOROPHENOXY)PROPYLCARBAMATE
3-TERT-BUTOXYCARBONYLAMINO-ISONICOTINIC ACID
6-BOC-HYDRAZINONICOTINIC ACID
4-BOCAMINO-NICOTINIC ACID
(S)-(-)-1-tert-Butoxycarbonyl-3-aminopyrrolidine
(R)-PIPERAZINE-2-CARBOXYLIC ACID
(3-HYDROXYMETHYL-PYRIDIN-4-YL)-CARBAMIC ACID TERT-BUTYL ESTER
6-(BOC-AMINO)-HEXYL BROMIDE
N-1-BOC-N-4-CBZ-2-PIPERAZINECARBOXYLIC ACID T-BUTYL ESTER
4-ALLYL-PIPERIDINE-1,4-DICARBOXYLIC ACID MONO-TERT-BUTYL ESTER
1-BOC-PIPERAZINE
TERT-BUTYL 4-(HYDROXYMETHYL)PYRIDIN-2-YLCARBAMATE
1-BOC-4-HYDROXY-4-(HYDROXYMETHYL)-PIPERIDINE
(S)-(-)-1-Boc-2-pyrrolidinemethanol
TERT-BUTYL 4-FORMYL-2-METHOXYPHENYL CARB ONATE, 99
3-[(N-(TERT-BUTYLOXYCARBONYL)AMINO)METHYL]PYRIDINE
tert-Butyl N-(2-bromoethyl)carbamate
N-Boc-N,N-bis(2-chloroethyl)amine
4-CHLORO-(N-BOC)ANILINE 97
TERT-BUTYL N-(2-HYDROXYETHYL)CARBAMATE
4-(BOC-AMINOMETHYL)PYRIDINE
N-BOC-piperidine-4-carboxylic acid
1-(4-PYRIDYLMETHYL)PIPERAZINE
N,N-DIMETHYL-2-PIPERAZIN-1-YL-ACETAMIDE
1-Boc-3-oxopiperazine

二叔丁基二碳酸酯 - Introduction

Open Data Unverified Data

Diethyl adipate (CAS 24424-99-5) is a compound with the chemical formula C10H18O5. It is a colorless and transparent liquid. Diethyl adipate is soluble in alcohols, ethers, and benzene, but insoluble in water, and it has a density of 0.932g/cm3.

Diethyl adipate is commonly used in the following areas:

1. Solvent: It is widely used as a solvent to dissolve certain compounds in chemical and laboratory applications due to its good solubility.
2. Chemical synthesis: It is used in organic synthesis reactions, for example, in the synthesis of polymers and other organic compounds.
3. Preparation of coatings and resins: In the coating industry, diethyl adipate can be used as a component in resins and coatings.

Diethyl adipate is typically synthesized by the reaction of butanol and carbon dioxide. It is relatively safe to handle, but precautions should be taken to avoid skin and eye contact, as well as inhalation of its vapors. It should be stored in a cool, dry place, away from sources of ignition and oxidizing agents.

Last Update:2024-04-09 19:43:38

二叔丁基二碳酸酯 - Nature

Open Data Unverified Data
storage conditions 2-8°C
morphology Low Melting Crystalline Solid
color White
Specific gravity 0.950
water solubility Miscible with decalin, toluene, carbon tetrachloride, tetrahydrofuran, dioxane, alcohols, acetone, acetonitrile and dimethylformamide. Immiscible with water.
sensitivity Moisture Sensitive
BRN 1911173
InChIKey DYHSDKLCOJIUFX-UHFFFAOYSA-N
EPA chemical information Dicarbonic acid, bis(1,1-dimethylethyl) ester (24424-99-5)
Last Update:2024-04-09 19:43:38

二叔丁基二碳酸酯 - Security information

WGK Germany 3
RTECS number HT0230000
F 4.4-10-21
auto-ignition temperature 460 °C
Hazard Note Flammable/Irritant/Very Toxic
TSCA Yes
HazardClass 6.1
PackingGroup I
customs code 29209010
Toxicity LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 2000 mg/kg
Last Update:2024-04-10 22:29:15

二叔丁基二碳酸酯 - Uses and synthesis methods

use

1. Used to introduce tert-butoxycarbonyl protecting groups in organic synthesis.

2, di-tert-butyl dicarbonate (Boc anhydride) is used in organic synthesis to introduce tert-butoxycarbonyl protection genes, especially used in amino acid protection. It is widely used in the synthesis of medicine, protein and polypeptide synthesis, biochemical food, cosmetics and other products.

3. amino acid BOC reagent. In organic synthesis, it is used to introduce tert-butoxyl carbonyl (BOC) protective group, especially suitable for amino acid protection. Tritertylbutoxycarbonyl-protected hydrazine can be prepared in chromogenic reagents for fluorene methoxycarbonyl? esters to monitor solid-phase aldehydes. Reagents used to prepare amines protected by tert-butoxycarbonyl. Reagents for the introduction of tert-butoxycarbonyl protecting groups. Alcohols such as tert-butoxycarbonyl derivatives can be protected by Lewis acid catalysis. Aminomethylpropene is prepared by the reaction of tert-butoxycarbonylaminopropyne with formaldehyde, diisopropylamine and copper bromide?, which is a component of many bovine plasma amine oxidase inactivators.

4. Used as an intermediate in medicine and organic synthesis, it is an important amino protective agent used in the synthesis of medicine and agrochemical products

production method

Potassium tert-butoxide is dissolved in anhydrous tetrahydrofuran, and dry carbon dioxide is introduced at -5 ~-20 ℃ to generate a slurry, continue to maintain a low temperature, and add phosgene benzene solution dropwise to prepare tert-butyl tricarbonate. Dissolve it in carbon tetrachloride, add an appropriate amount of 1,4-diazabicyclo [2,2] octane, stir at 25 ℃ to completely release carbon dioxide and convert it into ditert-butyl dicarbonate.

Last Update:2024-04-09 21:00:56
二叔丁基二碳酸酯
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View History
二叔丁基二碳酸酯
PCPF
1,1,3,3-四环戊烷基二氯二硅氧烷
CHLOROACETIC ACID DIETHYLAMIDE
2-氯-4甲氧基苯酚
2.5-二甲基四氢呋喃
孕甾-4-烯-17ALPHA,21-二醇-3,20-二酮-21-醋酸酯
哌拉西林
3-羟基-2-乙基-4-吡喃酮
氯甲基三甲硅烷
Raw Materials for 二叔丁基二碳酸酯
Tetrahydrofuran
Carbon tetrachloride
CARBON DIOXIDE
Potassium tert-butoxide
1,8-Diazabicyclo[5.4.0]undec-7-ene
N-OCTANE
Downstream Products for 二叔丁基二碳酸酯
N-Boc-D-proline
5-[N-(TERT-BUTOXYCARBONYL)AMINO]-2-CHLOROPYRIDINE
TERT-BUTYL 4-(5-FORMYL-4-METHYL-1,3-THIAZOL-2-YL)PIPERIDINE-1-CARBOXYLATE
1-Boc-4-cyanopiperidine
6-TERT-BUTOXYCARBONYLAMINO-PYRIDINE-2-CARBOXYLIC ACID
1-TERT-BUTYL 6-METHYL 3-FORMYL-1H-INDOLE-1,6-DICARBOXYLATE
(S)-N-Boc-allylglycine
TERT-BUTYL 3-FORMYLPYRIDIN-4-YLCARBAMATE
2-(2,2-DIMETHYL-PROPIONYLAMINO)-ISONICOTINIC ACID
1-Boc-piperazine acetate
3-TERT-BUTOXYCARBONYLAMINO-ISONICOTINIC ACID
6-BOC-HYDRAZINONICOTINIC ACID
(S)-(-)-1-tert-Butoxycarbonyl-3-aminopyrrolidine
(R)-PIPERAZINE-2-CARBOXYLIC ACID
N-1-BOC-N-4-CBZ-2-PIPERAZINECARBOXYLIC ACID T-BUTYL ESTER
1-BOC-PIPERAZINE
1-BOC-4-HYDROXY-4-(HYDROXYMETHYL)-PIPERIDINE
(S)-(-)-1-Boc-2-pyrrolidinemethanol
TERT-BUTYL 4-FORMYL-2-METHOXYPHENYL CARB ONATE, 99
3-[(N-(TERT-BUTYLOXYCARBONYL)AMINO)METHYL]PYRIDINE
TERT-BUTYL N-(2-HYDROXYETHYL)CARBAMATE
N,N-DIMETHYL-2-PIPERAZIN-1-YL-ACETAMIDE
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