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3,3-dichloroazepan-2-one

3,3-dichloroazepan-2-one structure

CAS No:
1709-14-4
Formula:
C6H9Cl2NO
Chemical Name:
3,3-dichloroazepan-2-one
Synonyms:
2,2-dichlorocaprolactam; 2H-Azepin-2-one,3,3-dichlorohexahydro; 3,3-Dichloro-2-azepanone; 3,3-dichlorohexahydro-2H-azepin-2-one; 3,3-dichloroperhydroazepin-2-one; 3,3-dichloro-hexahydro-azepin-2-one; 2H-Azepin-2-one, 3,3-dichlorohexahydro-; 3,3-Dichlor-hexahydro-azepin-2-on;Expand
Categories:
Dyes and Pigments > Dye

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3,3-dichloroazepan-2-one Basic Attributes

Molecular Weight：

182.04800

Exact Mass：

181.0061193 g/mol

NSC Number：

12943

DSSTox ID：

DTXSID10279508

HScode：

2933790090

Characteristics

PSA：

29.10000

XLogP3：

1.78920

Density：

1.32g/cm3

Boiling Point：

327.3ºC at 760mmHg

Flash Point：

151.8ºC

Refractive Index：

1.51

Vapor Pressure：

0.000203mmHg at 25°C

Computed Properties

Molecular Weight:182.04
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:181.0061193
Monoisotopic Mass:181.0061193
Topological Polar Surface Area:29.1
Heavy Atom Count:10
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes