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1884-42-0 | Cyclohexanol, 1-(3-methoxyphenyl)-
CAS No: 1884-42-0 Catalog No: AG002GVX MDL No:MFCD09701421
Product Description
Catalog Number:
AG002GVX
Chemical Name:
Cyclohexanol, 1-(3-methoxyphenyl)-
CAS Number:
1884-42-0
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
MDL Number:
MFCD09701421
IUPAC Name:
1-(3-methoxyphenyl)cyclohexan-1-ol
InChI:
InChI=1S/C13H18O2/c1-15-12-7-5-6-11(10-12)13(14)8-3-2-4-9-13/h5-7,10,14H,2-4,8-9H2,1H3
InChI Key:
FGCFTLWVTWVAPJ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1(O)CCCCC1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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