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3-Chloropropyl acetate

3-Chloropropyl acetate structure

CAS No:
628-09-1
Formula:
C5H9ClO2
Chemical Name:
3-Chloropropyl acetate
Synonyms:
1-Propanol,3-chloro-,1-acetate;1-Propanol,3-chloro-,acetate;3-Chloropropyl acetate;γ-Chloropropyl acetate;3-Acetoxypropyl chloride;3-Chloro-1-propyl acetate;Acetic acid 3-chloropropyl ester
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear colorless liquid

3-Chloropropyl acetate Basic Attributes

Molecular Weight：

136.58

Exact Mass：

136.58

DSSTox ID：

DTXSID80211879

HScode：

2915390090

Characteristics

PSA：

26.3

XLogP3：

1.3

Appearance：

clear colorless liquid

Density：

1.1150 g/cm³ @ Temp: 20 °C

Boiling Point：

164 °C

Flash Point：

67.8±0.0 °C

Refractive Index：

1.420

Water Solubility：

Soluble in water (partly).

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38:Irritating to eyes, respiratory system and skin .

safety instructions：

S26-S36/37/39

RTECS Number：

UA8944000

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:136.58
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:136.0291072
Monoisotopic Mass:136.0291072
Topological Polar Surface Area:26.3
Heavy Atom Count:8
Complexity:72.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 628-09-1

Grade: Industrial Grade

Content: 99%

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