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18890-22-7 | 2-Cyclohexen-1-ol, 3-methyl-, (1R)-
CAS No: 18890-22-7 Catalog No: AG002HHD MDL No:
Product Description
Catalog Number:
AG002HHD
Chemical Name:
2-Cyclohexen-1-ol, 3-methyl-, (1R)-
CAS Number:
18890-22-7
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
IUPAC Name:
(1R)-3-methylcyclohex-2-en-1-ol
InChI:
InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h5,7-8H,2-4H2,1H3/t7-/m1/s1
InChI Key:
XNDZQQSKSQTQQD-SSDOTTSWSA-N
SMILES:
CC1=C[C@@H](CCC1)O
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
112.089g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.172g/mol
Monoisotopic Mass:
112.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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