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1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL

1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL structure

CAS No:
109162-29-0
Formula:
C13H19NO
Chemical Name:
1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL
Synonyms:
1-benzylazepan-4-ol;1-Benzyl-4-hydroxyazepane;1-Benzyl-hexahydro-4H-azepin-4-ol;1H-Azepin-4-ol,hexahydro-1-(phenylmethyl)-;1-benzyl-4-azepanol;1-Benzyl-azepan-4-ol;ACMC-1BREA;SCHEMBL5401732;CTK4A6357;DTXSID90403208

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1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL Basic Attributes

Molecular Weight：

205.3

Exact Mass：

205.14700

DSSTox ID：

DTXSID90403208

HScode：

2933990090

Characteristics

PSA：

23.5

XLogP3：

1.97130

Density：

1.077g/cm3

Boiling Point：

325.2ºC at 760mmHg

Flash Point：

103.3ºC

Refractive Index：

1.564

Computed Properties

Molecular Weight:205.30
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:205.146664230
Monoisotopic Mass:205.146664230
Topological Polar Surface Area:23.5
Heavy Atom Count:15
Complexity:177
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL

Basic Attributes
Characteristics
Computed Properties

1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL

SDS

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