Benzoyl Chloride - Materials / Alfa Chemistry

NAVIGATION

Benzoyl Chloride

PRICE INQUIRY

Catalog Number

ACMA00017310

Product Name

Benzoyl Chloride

Category

Polymers

Description

Benzoyl chloride appears as a colorless fuming liquid with a pungent odor. Flash point 162°F. Lachrymator, irritating to skin and eyes. Corrosive to metals and tissue. Density 10.2 lb / gal. Used in medicine and in the manufacture of other chemicals.;Liquid;FUMING COLOURLESS LIQUID WITH PUNGENT ODOUR.;A colorless fuming liquid with a pungent odor.

IUPAC Name

benzoyl chloride

Molecular Weight

140.56g/mol

Molecular Formula

C7H5ClO;C6H5COCl;C6H5COCl;C7H5ClO

Canonical SMILES

C1=CC=C(C=C1)C(=O)Cl

InChI

InChI=1S/C7H5ClO/c8-7(9)6-4-2-1-3-5-6/h1-5H

InChI Key

PASDCCFISLVPSO-UHFFFAOYSA-N

Boiling Point

387 °F at 760 mm Hg (NTP, 1992);197.2 °C;201 °C;197.2 °C;387°F

Melting Point

30.2 °F (NTP, 1992);-1.0 °C;-0.5 °C;-1 °C;30.2°F

Flash Point

162 °F (NTP, 1992);72 °C (162 °F) - closed cup;162 °F (72 °C)(open cup);68 °C (closed cup);72 °C c.c.;162°F

Density

1.211 at 77 °F (USCG, 1999);1.2070 at 25 °C/4 °C;Relative density (water = 1): 1.21;1.211

Solubility

Decomposes (NTP, 1992);In water, 1.05X10+4 mg/L at 25 °C (est);Decomposed by water, alcohol;Miscible with ethyl ether; soluble in benzene, carbon tetrachloride, carbon disulfide;Miscible with ether, benzene, carbon disulfide, oils;Soluble in ether and carbon disulfide;Solubility in water: reaction

Color/Form

Liquid;Transparent, colorless liquid;Colorless, fuming liquid;Colorless to slightly yellow liquid

Complexity

106

Corrosivity

Slow corrosion of metals

Covalently-Bonded Unit Count

EC Number

202-710-8

Exact Mass

140.002893g/mol

Formal Charge

Heat of Vaporization

11,438.0 gcal/gmol

Heavy Atom Count

ICSC Number

1015

Log P

log Kow = 1.44 (est)

MeSH Entry Terms

benzoyl chloride

Monoisotopic Mass

140.002893g/mol

Odor

Penetrating odor;Fuming pungent;Pungent, aromatic

Other Experimental

BP: 197.2 °C at 760 mm Hg;Decomposes in water;Dipole moment: 3.28 debyes;VP: 1 mm Hg at 32.1 °C;Henry's Law constant = 1.32X10-4 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 1.78X10-12 cu cm/mole-sec at 25 °C (est)

Refractive Index

Index of refraction: 1.5537 at 20 °C/D

Rotatable Bond Count

RTECS Number

DM6600000

Stability

Stable under recommended storage conditions.

UNII

VTY8706W36

UN Number

1736;1736;1736;1736

Vapor Density