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Product No: AW8346

4-(CHLOROMETHYL)PHENYL ACETATE, 97%

Name: 4-(CHLOROMETHYL)PHENYL ACETATE
Brand: Chempure

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CAS Number

39720-27-9

Molecular Weight

184.62

Formula

C9H9ClO2

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About this item

IUPAC name	[4-(chloromethyl)phenyl] acetate
canonical smiles	CC(=O)OC1=CC=C(C=C1)CCl
inchi	InChI=1S/C9H9ClO2/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-5H,6H2,1H3
inchi key	OKRCXSCDWKJWSW-UHFFFAOYSA-N
molecular formula	C9H9ClO2
synonyms	4-(Chloromethyl)phenyl acetate 39720-27-9 [4-(chloromethyl)phenyl] acetate p-Acetoxybenzyl chloride Phenol, 4-(chloromethyl)-, acetate

Computed Properties

Molecular Weight:	184.62 g/mol
XLogP3:	2.1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	3
Exact Mass:	184.0291072 g/mol
Monoisotopic Mass:	184.0291072 g/mol
Topological Polar Surface Area:	26.3 Å²
Heavy Atom Count:	12
Formal Charge:	0
Complexity:	151
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

Related Compounds

Benzaldehyde

Acetanilide

Styrene oxide

alpha-Methylstyrene

Acetophenone

4-Methylbenzaldehyde

Benzyl acetate

Dimethyl terephthalate

Formanilide

Phenyl Isothiocyanate

Phenylacetaldehyde

3-Acetylpyridine

Metolcarb

Phenyl acetate

Carbanolate

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (100%) Skin Corr. 1B (100%) Skin Sens. 1 (100%)
precautionary statement codes	P260, P261, P264, P270, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P405, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]

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About this item

Documentation

Certificate of Analysis

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: AW8346

4-(CHLOROMETHYL)PHENYL ACETATE, 97%

Product No: AW8346

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

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Product No: AW8346

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?