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158813-13-9 | 1-Hexene, 3-chloro-4-methyl-
CAS No: 158813-13-9 Catalog No: AG001QWC MDL No:
Product Description
Catalog Number:
AG001QWC
Chemical Name:
1-Hexene, 3-chloro-4-methyl-
CAS Number:
158813-13-9
Molecular Formula:
C7H13Cl
Molecular Weight:
132.6311
IUPAC Name:
3-chloro-4-methylhex-1-ene
InChI:
InChI=1S/C7H13Cl/c1-4-6(3)7(8)5-2/h5-7H,2,4H2,1,3H3
InChI Key:
CWHMOVMLMJJHNT-UHFFFAOYSA-N
SMILES:
CCC(C(C=C)Cl)C
Properties
Complexity:
68.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.071g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.631g/mol
Monoisotopic Mass:
132.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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