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83867-60-1 | Cyclohexene, 6-chloro-1-methyl-4-(1-methylethenyl)-, (4S,6R)-
CAS No: 83867-60-1 Catalog No: AG005453 MDL No:
Product Description
Catalog Number:
AG005453
Chemical Name:
Cyclohexene, 6-chloro-1-methyl-4-(1-methylethenyl)-, (4S,6R)-
CAS Number:
83867-60-1
Molecular Formula:
C10H15Cl
Molecular Weight:
170.6791
IUPAC Name:
(4S,6R)-6-chloro-1-methyl-4-prop-1-en-2-ylcyclohexene
InChI:
InChI=1S/C10H15Cl/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-10H,1,5-6H2,2-3H3/t9-,10+/m0/s1
InChI Key:
GRROGOVISQZGNO-VHSXEESVSA-N
SMILES:
CC(=C)[C@H]1CC=C([C@@H](C1)Cl)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
170.086g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.68g/mol
Monoisotopic Mass:
170.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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