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85015-22-1 | 2-Pentene, 1,1,1,4-tetrachloro-4-methyl-
CAS No: 85015-22-1 Catalog No: AG0050P2 MDL No:
Product Description
Catalog Number:
AG0050P2
Chemical Name:
2-Pentene, 1,1,1,4-tetrachloro-4-methyl-
CAS Number:
85015-22-1
Molecular Formula:
C6H8Cl4
Molecular Weight:
221.9397
IUPAC Name:
1,1,1,4-tetrachloro-4-methylpent-2-ene
InChI:
InChI=1S/C6H8Cl4/c1-5(2,7)3-4-6(8,9)10/h3-4H,1-2H3
InChI Key:
PMCHCFRDFYHEFJ-UHFFFAOYSA-N
SMILES:
CC(C=CC(Cl)(Cl)Cl)(Cl)C
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.935g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.93g/mol
Monoisotopic Mass:
219.938g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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