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115560-84-4 | Benzene, (1,1-dichlorohexyl)-
CAS No: 115560-84-4 Catalog No: AG000G66 MDL No:
Product Description
Catalog Number:
AG000G66
Chemical Name:
Benzene, (1,1-dichlorohexyl)-
CAS Number:
115560-84-4
Molecular Formula:
C12H16Cl2
Molecular Weight:
231.1614
IUPAC Name:
1,1-dichlorohexylbenzene
InChI:
InChI=1S/C12H16Cl2/c1-2-3-7-10-12(13,14)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3
InChI Key:
HSXSUCNPFUEKAJ-UHFFFAOYSA-N
SMILES:
CCCCCC(c1ccccc1)(Cl)Cl
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.16g/mol
Monoisotopic Mass:
230.063g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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