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2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol,hydrochloride

2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol,hydrochloride structure

CAS No:
16584-13-7
Formula:
C18H19BrClNOS
Chemical Name:
2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol,hydrochloride
Synonyms:
Ethanol,2-(benzyl((5-bromobenzo(b)thien-3-yl)methyl)amino)-,hydrochloride; 2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol hydrochloride; Ethanol,2-(((5-bromobenzo(b)thien-3-yl)methyl)phenylmethyl)amino-,hydrochloride; 2-(Benzyl((5-bromobenzo(b)thien-3-yl)methyl)amino)ethanol hydrochloride;

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2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol,hydrochloride Basic Attributes

Molecular Weight：

412.77200

Exact Mass：

411.00593 g/mol

DSSTox ID：

DTXSID60168039

Characteristics

PSA：

51.71000

XLogP3：

5.46030

Boiling Point：

495.4ºC

Flash Point：

253.4ºC

Vapor Pressure：

1.24E-10mmHg at 25°C

Computed Properties

Molecular Weight:412.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:411.00593
Monoisotopic Mass:411.00593
Topological Polar Surface Area:51.7
Heavy Atom Count:23
Complexity:337
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-[benzyl-[(5-bromo-1-benzothiophen-3-yl)methyl]amino]ethanol,hydrochloride

Basic Attributes
Characteristics
Computed Properties

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