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88699-98-3 | Cyclohexene, 4-(2-chloro-1-methylethenyl)-1-methyl-
CAS No: 88699-98-3 Catalog No: AG0047FD MDL No:
Product Description
Catalog Number:
AG0047FD
Chemical Name:
Cyclohexene, 4-(2-chloro-1-methylethenyl)-1-methyl-
CAS Number:
88699-98-3
Molecular Formula:
C10H15Cl
Molecular Weight:
170.6791
IUPAC Name:
4-(1-chloroprop-1-en-2-yl)-1-methylcyclohexene
InChI:
InChI=1S/C10H15Cl/c1-8-3-5-10(6-4-8)9(2)7-11/h3,7,10H,4-6H2,1-2H3
InChI Key:
HQIKGZMLMNJTIT-UHFFFAOYSA-N
SMILES:
ClC=C(C1CCC(=CC1)C)C
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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