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1314915-80-4 | 2-Chloro-6,6-dimethyl-1-heptene
CAS No: 1314915-80-4 Catalog No: AG01FEV4 MDL No:
Product Description
Catalog Number:
AG01FEV4
Chemical Name:
2-Chloro-6,6-dimethyl-1-heptene
CAS Number:
1314915-80-4
Molecular Formula:
C9H17Cl
Molecular Weight:
160.6843
IUPAC Name:
2-chloro-6,6-dimethylhept-1-ene
InChI:
InChI=1S/C9H17Cl/c1-8(10)6-5-7-9(2,3)4/h1,5-7H2,2-4H3
InChI Key:
JHVINVVPYBEENS-UHFFFAOYSA-N
SMILES:
ClC(=C)CCCC(C)(C)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.102g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.685g/mol
Monoisotopic Mass:
160.102g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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