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1004-24-6 | Cyclohexanemethanol, 4-methylene-
CAS No: 1004-24-6 Catalog No: AG0001X4 MDL No:MFCD00045564
Product Description
Catalog Number:
AG0001X4
Chemical Name:
Cyclohexanemethanol, 4-methylene-
CAS Number:
1004-24-6
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
MDL Number:
MFCD00045564
IUPAC Name:
(4-methylidenecyclohexyl)methanol
InChI:
InChI=1S/C8H14O/c1-7-2-4-8(6-9)5-3-7/h8-9H,1-6H2
InChI Key:
VEDQBZWFMDUFHU-UHFFFAOYSA-N
SMILES:
OCC1CCC(=C)CC1
UNII:
41ZEO89RKY
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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