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Benzo[b]thiophene-3-ethanamine

Benzo[b]thiophene-3-ethanamine structure

CAS No:
14585-66-1
Formula:
C10H11NS
Chemical Name:
Benzo[b]thiophene-3-ethanamine
Synonyms:
Benzo[b]thiophene-3-ethanamine;Benzo[b]thiophene-3-ethylamine;3-(2-Aminoethyl)benzo[b]thiophene;3-(2-Aminoethyl)benzothiophene;[2-(Benzo[b]thiophen-3-yl)ethyl]amine;2-(Benzo[b]thien-3-yl)ethanamine;2-(1-Benzothiophen-3-yl)ethan-1-amine;2-(1-Benzothiophen-3-yl)ethanamine
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Benzo[b]thiophene-3-ethanamine Basic Attributes

Molecular Weight：

177.26604

Exact Mass：

177.27

DSSTox ID：

DTXSID00163169

HScode：

2934999090

Characteristics

PSA：

54.26000

XLogP3：

3.10280

Density：

1.185±0.06 g/cm3(Predicted)

Boiling Point：

125 °C @ Press: 1 Torr

Flash Point：

144.3ºC

Refractive Index：

1.665

Safety Information

Precautionary statement(s)：

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

Hazard Statements：

H315

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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:177.27
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:177.06122053
Monoisotopic Mass:177.06122053
Topological Polar Surface Area:54.3
Heavy Atom Count:12
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzo[b]thiophene-3-ethanamine

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Benzo[b]thiophene-3-ethanamine

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