3-BROMO-1-PHENYLPROPANE

Name	1-Bromo-3-phenylpropane
Synonyms	TIMTEC-BB SBB008835 Hydrocinnamyl bromide 3-PHENYLPROPYL BROMIDE (3-BROMOPROPYL)BENZENE (3-Bromopropyl)benzene 3-Phenylpropyl bromide G-PHENYLPROPYL BROMIDE 1-BROMO-3-PHENYLPROPANE 3-BROMO-1-PHENYLPROPANE 3-Phenyl propyl bromide 1-Bromo-3-phenylpropane 1-Bromo-3-phenyl propane gamma-Phenylpropyl bromide
CAS	637-59-2
EINECS	211-294-7
InChI	InChI=1/C9H11Br/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2

Molecular Formula	C9H11Br
Molar Mass	199.09
Density	1.31 g/mL at 25 °C (lit.)
Melting Point	-10°C (estimate)
Boling Point	237-238 °C (lit.)
Flash Point	215°F
Water Solubility	INSOLUBLE
Solubility	Chloroform, Methanol
Appearance	Liquid
Specific Gravity	1.31
Color	Clear colorless to light yellow
BRN	2205527
Storage Condition	Inert atmosphere,Room Temperature
Refractive Index	n20/D 1.546(lit.)
MDL	MFCD00000257

Risk Codes	R22 - Harmful if swallowed R36/38 - Irritating to eyes and skin. R36/37/38 - 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. S37/39 - Wear suitable gloves and eye/face protection
UN IDs	2810
WGK Germany	3
TSCA	Yes
HS Code	29036990

Insoluble in water.

Last Update：2022-10-16 17:27:36

NIST chemical information	information provided by: webbook.nist.gov (external link)
EPA chemical substance information	information provided by: ofmpeb.epa.gov (external link)
Use	1-bromo-3-phenylpropane is an organic intermediate, obtained after bromination. It has been reported in the literature that it can be used to prepare alverine, a calcium channel modulator.
preparation	dissolve phenylpropanol (137G, 1mol) in triethylamine (205G, 2mol) methylene chloride solvent 900mL, cooled to 0-5 ℃, slowly drop add methanesulfonyl chloride (1.5g, mol), drop, slowly rise to 25~30 ℃, stir react for 2-4H, monitor the reaction by TLC, concentrate the reaction solution to dryness to obtain the compound of Formula 3; Without separation, add proper amount of DMF to dissolve, add sodium bromide (255g,2.5mol), stir at 25~30 ℃ for 6~8H, monitor the reaction by TLC, filter, add water 800mL and ethyl acetate 1000mL, the organic layer was washed, dried and concentrated to obtain about 160g of 1-bromo-3-phenylpropane.

Last Update：2024-04-09 02:00:10

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