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1,3-Dichlorocyclohexane (cis)

HCID 32749
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Basic information

CAS
24955-63-3
Standard SMILES
Cl[C@@H]1CCC[C@H](Cl)C1
InChIKey
HXWLCXAXTOJPJL-OLQVQODUSA-N
Molecular formula
C6H10Cl2
Average molar mass
153.05 g/mol
Monoisotopic mass
152.0159557

Names & identifiers

Preferred name
1,3-Dichlorocyclohexane (cis)
IUPAC
cis-(1S,3R)-1,3-dichlorocyclohexane
English name
1α,3α-Dichlorocyclohexane
Molecular formula
C6H10Cl2
Molecular weight
153.05

Names & synonyms

1,3-DICHLOROCYCLOHEXANE (CIS)24955-63-3DTXSID20179666RefChem:1052814DTXCID80102157cis-1,3-Dichlorocyclohexane(1R,3S)-1,3-dichlorocyclohexaneCyclohexane, 1,3-dichloro-, cis-(Z)-1,3-DichlorocyclohexaneHXWLCXAXTOJPJL-OLQVQODUSA-NCyclohexane, 1,3-dichloro-, (1R,3S)-rel-

Database identifiers

CAS
24955-63-3
PubChem CID
32749
DTXSID
DTXSID20179666
Nikkaji
J100.059D

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
64.9

Physicochemical properties

Boiling point
213.381 · 213.381±15.00 °C(Press: 760.00 Torr)(predicted)
Density
1.147 · 1.147±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)

Related reactions

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Compound notes

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