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3-(2-Bromoethyl)indole

3-(2-Bromoethyl)indole structure

CAS No:
3389-21-7
Formula:
C10H10BrN
Chemical Name:
3-(2-Bromoethyl)indole
Synonyms:
1H-Indole,3-(2-bromoethyl)-;Indole,3-(2-bromoethyl)-;3-(2-Bromoethyl)-1H-indole;3-(2-Bromoethyl)indole;3-(Bromoethyl)-1H-indole;2-(3-Indolyl)ethyl bromide;1-Bromo-2-(3-indolyl)ethane
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

Yellow Solid

3-(2-Bromoethyl)indole Basic Attributes

Molecular Weight：

224.097

Exact Mass：

224.10

EC Number：

222-219-2

DSSTox ID：

DTXSID10187513

HScode：

2933990090

Characteristics

PSA：

15.79000

XLogP3：

3.01

Density：

1.5±0.1 g/cm3

Melting Point：

96-97 °C

Boiling Point：

343.5±17.0 °C at 760 mmHg

Flash Point：

161.5±20.9 °C

Refractive Index：

1.679

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

26-37/39

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (95.12%): 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 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3-(2-bromoethyl)indole

Computed Properties

Molecular Weight:224.10
XLogP3:3.3
Hydrogen Bond Donor Count:1
Rotatable Bond Count:2
Exact Mass:222.99966
Monoisotopic Mass:222.99966
Topological Polar Surface Area:15.8
Heavy Atom Count:12
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes