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4-Chloroindole

4-Chloroindole structure

CAS No:
25235-85-2
Formula:
C8H6ClN
Chemical Name:
4-Chloroindole
Synonyms:
1H-Indole,4-chloro-;Indole,4-chloro-;4-Chloro-1H-indole;4-Chloroindole;NSC 88141;1425049-53-1
Categories:
Organic Chemistry > Alcohols, Phenols, Phenol Alcohols

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4-Chloroindole Basic Attributes

Molecular Weight：

151.59300

Exact Mass：

151.59

EC Number：

246-747-8

NSC Number：

88141

DSSTox ID：

DTXSID30179894

HScode：

2933990090

Characteristics

PSA：

15.79000

XLogP3：

2.82130

Appearance：

clear yellow liquid (clear)

Density：

1.2485 g/cm³ @ Temp: 20 °C

Boiling Point：

143 °C @ Press: 10 Torr

Flash Point：

158.9ºC

Refractive Index：

1.627-1.629

Water Solubility：

insoluble

Storage Conditions：

2-8ºC

Vapor Pressure：

0.00309mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

R20/21/22; R36/37/38

safety instructions：

S26-S36/37/39

Marks：

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

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 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-chloroindole

Computed Properties

Molecular Weight:151.59
XLogP3:3.4
Hydrogen Bond Donor Count:1
Exact Mass:151.0188769
Monoisotopic Mass:151.0188769
Topological Polar Surface Area:15.8
Heavy Atom Count:10
Complexity:126
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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