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1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone

1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone structure

CAS No:
57756-36-2
Formula:
C11H14N2O
Chemical Name:
1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone
Synonyms:
Ethanone,1-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-;1H-1,4-Benzodiazepine,4-acetyl-2,3,4,5-tetrahydro-;1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone;4-Acetyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine;1-(1,2,3,5-Tetrahydro-1,4-benzodiazepin-4-yl)ethanone;1-(2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-4-yl)ethan-1-one

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Description

Pale yellow powder

1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone Basic Attributes

Molecular Weight：

190.24

Exact Mass：

190.24

EC Number：

611-574-2

DSSTox ID：

DTXSID70465743

HScode：

2933990090

Characteristics

PSA：

32.3

XLogP3：

0.68

Appearance：

Class white to pale yellow crystalline powder

Density：

1.1±0.1 g/cm3

Melting Point：

85 °C @ Solvent: Ethyl acetate, Hexane

Boiling Point：

393.4±31.0 °C at 760 mmHg

Flash Point：

191.7±24.8 °C

Refractive Index：

1.546

Computed Properties

Molecular Weight:190.24
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:190.110613074
Monoisotopic Mass:190.110613074
Topological Polar Surface Area:32.3
Heavy Atom Count:14
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone

Description
Basic Attributes
Characteristics
Computed Properties

1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone

SDS

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