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1,1-Dibromooctane

HCID 43939
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Basic information

CAS
62168-26-7
Standard SMILES
CCCCCCCC(Br)Br
InChIKey
STBMZSJLFYGOJU-UHFFFAOYSA-N
Molecular formula
C8H16Br2
Average molar mass
272.02 g/mol
Monoisotopic mass
269.96188

Names & identifiers

Preferred name
1,1-Dibromooctane
IUPAC
1,1-dibromooctane

Names & synonyms

1,1-DIBROMOOCTANEdibromooctane62168-26-7Octane, 1,1-dibromo-SCHEMBL688817SCHEMBL2090578DTXSID10211221STBMZSJLFYGOJU-UHFFFAOYSA-N

Database identifiers

CAS
62168-26-7、92477-31-1
PubChem CID
43939
DTXSID
DTXSID10211221
Nikkaji
J1.622.276C

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
6
Heavy atoms
10
Formal charge
0
Complexity
62.3

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Related reactions

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Compound notes

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