2-[(phenylcarbamoyl)oxy]propanoic acid

2-[(phenylcarbamoyl)oxy]propanoic acid - Names and Identifiers

Name	(S)-(-)-2-(PHENYLCARBAMOYLOXY)PROPIONIC ACID
Synonyms	(S)-PACOPA BROWN'S REAGENT CARBAMALACTIC ACID (S)-(-)-Brown'sReagent (S)-(-)-CARBAMALACTIC ACID 2-[(phenylcarbamoyl)oxy]propanoic acid (2S)-2-[(phenylcarbamoyl)oxy]propanoate (2S)-2-[(phenylcarbamoyl)oxy]propanoic acid (S)-(-)-2-(PHENYLCARBAMOYLOXY)PROPIONIC ACID (S)-(-)-2-[(PHENYLAMINO)CARBONYLOXY]PROPIONIC ACID
CAS	102936-05-0
InChI	InChI=1/C10H11NO4/c1-7(9(12)13)15-10(14)11-8-5-3-2-4-6-8/h2-7H,1H3,(H,11,14)(H,12,13)/p-1/t7-/m0/s1

2-[(phenylcarbamoyl)oxy]propanoic acid - Physico-chemical Properties

Molecular Formula	C10H11NO4
Molar Mass	209.2
Density	1.2944 (rough estimate)
Melting Point	150°C (dec.)(lit.)
Boling Point	348.55°C (rough estimate)
Flash Point	150.2°C
Vapor Presure	9.87E-05mmHg at 25°C
Appearance	Crystalline Powder
Color	White to off-white
pKa	2.85±0.10(Predicted)
Refractive Index	1.5400 (estimate)
MDL	MFCD00063138
Physical and Chemical Properties	WGK Germany:3

2-[(phenylcarbamoyl)oxy]propanoic acid - Risk and Safety

Hazard Symbols	Xi - Irritant
Risk Codes	36/37/38 - Irritating to eyes, respiratory system and skin.
Safety Description	S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S37/39 - Wear suitable gloves and eye/face protection
WGK Germany	3
HS Code	29224985

2-[(phenylcarbamoyl)oxy]propanoic acid - Introduction

(S)-(-)-2-[propylaminocarbonyloxy] propionic acid, also known as S-IBOP acid, is an organic compound. The following is a description of its nature, use, formulation and safety information:

Nature:
(S)-(-)-2-[propylaminocarbonyloxy] propionic acid is a colorless crystalline or powdery solid. It has a unique three-dimensional structure, is a chiral compound, with optical rotation. Its chemical formula is C7H11NO4 and its molecular weight is 169.17g/mol.

Use:
(S)-(-)-2-[propylaminocarbonyloxy] propionic acid has important application value in the field of organic synthesis. It is a chiral catalyst and plays an important role in symmetric and asymmetric synthesis. It can be used to synthesize chiral drugs, natural products and other organic molecules.

Preparation Method:
(S)-(-)-2-[propylaminocarbonyloxy] propionic acid can be obtained by chemical synthesis or biological synthesis. One such chemical synthesis is the reaction of 2-bromopropionic acid with (L)-alaninol to give the compound.

Safety Information:
Under proper use and storage,(S)-(-)-2-[propylaminocarbonyloxy] propionic acid has low toxicity. However, as an organic compound, it is still necessary to take necessary safety measures. When using, avoid direct contact with skin and eyes, and maintain a well-ventilated working environment. At the same time, it should be stored in a dry, cool place, away from fire and oxidizing agents. If necessary, treatment and disposal of waste should be carried out in a suitable environment.

Last Update：2024-04-09 21:11:58