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1-Chloro-3-phenylpropane

1-Chloro-3-phenylpropane structure

CAS No:
104-52-9
Formula:
C9H11Cl
Chemical Name:
1-Chloro-3-phenylpropane
Synonyms:
Benzene,(3-chloropropyl)-;(3-Chloropropyl)benzene;3-Phenylpropyl chloride;γ-Phenylpropyl chloride;3-Chloro-1-phenylpropane;γ-Chloropropylbenzene;1-Chloro-3-phenylpropane;3-Phenyl-1-chloropropane;NSC 16939
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear colorless to light yellow liquid

1-Chloro-3-phenylpropane Basic Attributes

Molecular Weight：

154.64

Exact Mass：

154.64

EC Number：

203-210-2

UNII：

E2L2KN77K8

NSC Number：

16939

DSSTox ID：

DTXSID10146206

HScode：

29036990

Characteristics

PSA：

XLogP3：

3.5

Appearance：

clear colorless to light yellow liquid

Density：

1.08 g/mL at 25 °C(lit.)

Melting Point：

-27 °C

Boiling Point：

219.5 °C

Flash Point：

189 °F

Refractive Index：

n 20/D 1.521(lit.)

Water Solubility：

SLIGHTLY SOLUBLE

Storage Conditions：

Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Vapor Pressure：

0.17mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

R38

safety instructions：

23-28-37

Marks：

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (97.92%): 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 51 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:154.63
XLogP3:3.5
Rotatable Bond Count:3
Exact Mass:154.0549280
Monoisotopic Mass:154.0549280
Heavy Atom Count:10
Complexity:74.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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