(2-Methylphenyl) methyl chloroformate

CAT: 0926-TMB59213-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-TMB59213-01Size:50 mg

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CAS Number

943592-13-0

MDL Number

MFCD25969365

Smiles

CC1=CC=CC=C1COC (=O) Cl

Molecular Formula

C9H9ClO2

Molecular Weight

184.62 g/mol

Controlled

Chemical Information

2-Methylbenzyloxycarbonyl chloride

CAS Number	943592-13-0
PubChem CID	13292930
IUPAC Name	(2-methylphenyl)methyl carbonochloridate
Molecular Formula	C9H9ClO2
Molecular Weight	184.62
XLogP	3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	159

SMILES

CC1=CC=CC=C1COC(=O)Cl

InChI

InChI=1S/C9H9ClO2/c1-7-4-2-3-5-8(7)6-12-9(10)11/h2-5H,6H2,1H3

InChIKey

ZONRLWCQDWMCAR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 943592-13-0

CID: 13292930

Formula: C9H9ClO2

MW: 184.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	184.62
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	184.0291072
Monoisotopic Mass	184.0291072
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	159
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
EBA43039-01	3-Methylphenyl chloroformate
CMC20186-01	4-Fluoro-2-methylphenyl chloroformate
BDC30894-01	(2-Fluorophenyl) methyl chloroformate
BQB09514-01	4-Fluoro-3-methylphenyl chloroformate
IQA12727-01	2-[ (2-Methylphenyl) methyl]pyrrolidine
QLA81903	2-Heptyl chloroformate
HCA91341-01	2-Phenylethyl chloroformate
HAA69350	2-Naphthyl Chloroformate
QDA51212-01	2-Propoxyethyl chloroformate
AAA62812-01	2-Methoxyethyl Chloroformate

Catalog	Name
OR1994-01	4-Methylphenyl chloroformate
C366740	Methyl Chloroformate
C366742	Methyl-d3 Chloroformate
M14280	Methyl chloroformate 99%
OR1047743-01	(3-Methoxyphenyl) methyl chloroformate
171700500	Methyl Chloroformate 98% For Synthesis
RG-A260910-01	Methyl chloroformate (controlled substance)
OR929958	2-[ (2-Methylphenyl) methyl]pyrrolidine
OR1089964-01	2-Methyl-α- (2-methylphenyl) benzenemethanol
628-12-6	2-METHOXYETHYL CHLOROFORMATE