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130747-83-0 | 1,3-Butanediol, 2-cyclohexylidene-3-methyl-
CAS No: 130747-83-0 Catalog No: AG000UWO MDL No:
Product Description
Catalog Number:
AG000UWO
Chemical Name:
1,3-Butanediol, 2-cyclohexylidene-3-methyl-
CAS Number:
130747-83-0
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
2-cyclohexylidene-3-methylbutane-1,3-diol
InChI:
InChI=1S/C11H20O2/c1-11(2,13)10(8-12)9-6-4-3-5-7-9/h12-13H,3-8H2,1-2H3
InChI Key:
IMXGGTJBEINDOP-UHFFFAOYSA-N
SMILES:
OCC(=C1CCCCC1)C(O)(C)C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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