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4-Chloroanisole

4-Chloroanisole structure

CAS No:
623-12-1
Formula:
C7H7ClO
Chemical Name:
4-Chloroanisole
Synonyms:
Benzene,1-chloro-4-methoxy-;Anisole,p-chloro-;1-Chloro-4-methoxybenzene;p-Chloroanisole;p-Chlorophenyl methyl ether;4-Chloroanisole;4-Chlorophenol methyl ether;Anisyl chloride;p-Chloromethoxybenzene;p-Methoxychlorobenzene;4-Methoxychlorobenzene;4-Methoxyphenyl chloride;p-Methoxyphenyl chloride;1-Methoxy-4-chlorobenzene;NSC 4129;4-Methoxy-1-chlorobenzene;4-Chlorophenyl methyl ether;4-Chloro-1-methoxybenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

colourless liquid

4-Chloroanisole Basic Attributes

Molecular Weight：

142.582

Exact Mass：

142.58

EC Number：

210-772-2

UNII：

0F18BLY08Q

NSC Number：

4129

DSSTox ID：

DTXSID1060764

HScode：

2909309090

Characteristics

PSA：

9.2

XLogP3：

2.8

Appearance：

colourless liquid

Density：

1.1±0.1 g/cm3

Melting Point：

<-18 °C

Boiling Point：

197.5 °C

Flash Point：

78.3±0.0 °C

Refractive Index：

1.515

Water Solubility：

H2O: immiscible

Storage Conditions：

Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Peroxide Forming Chemical：

p-Chloroanisole|D*: Other compounds that may form peroxides|No amount of peroxides were found in new commerically available containers|Removal of Peroxides from Ethers with Cerous Hydroxide

Safety Information

Transport codes：

UN 2810

wgk germany：

safety instructions：

S23-S24/25

Marks：

Xn: Harmful;

Stability/Shelf Life：

Stable. Combustible. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 9 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-chloroanisole

4-Chloroanisole Use and Manufacturing

Manufacturing Info：

Benzene, 1-chloro-4-methoxy-: INACTIVE

Computed Properties

Molecular Weight:142.58
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:142.0185425
Monoisotopic Mass:142.0185425
Topological Polar Surface Area:9.2
Heavy Atom Count:9
Complexity:77
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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