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18993-24-3 | Pentane, 1,1,1,3,5,5-hexachloro-
CAS No: 18993-24-3 Catalog No: AG002E5F MDL No:
Product Description
Catalog Number:
AG002E5F
Chemical Name:
Pentane, 1,1,1,3,5,5-hexachloro-
CAS Number:
18993-24-3
Molecular Formula:
C5H6Cl6
Molecular Weight:
278.8191
IUPAC Name:
1,1,1,3,5,5-hexachloropentane
InChI:
InChI=1S/C5H6Cl6/c6-3(1-4(7)8)2-5(9,10)11/h3-4H,1-2H2
InChI Key:
MTBZFCJQMJGQRT-UHFFFAOYSA-N
SMILES:
ClC(CC(CC(Cl)(Cl)Cl)Cl)Cl
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.857g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.803g/mol
Monoisotopic Mass:
275.86g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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