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138828-54-3 | Cyclohexanepropanol, 4-(4-methoxyphenyl)-, trans-
CAS No: 138828-54-3 Catalog No: AG0019MT MDL No:
Product Description
Catalog Number:
AG0019MT
Chemical Name:
Cyclohexanepropanol, 4-(4-methoxyphenyl)-, trans-
CAS Number:
138828-54-3
Molecular Formula:
C16H24O2
Molecular Weight:
248.3606
IUPAC Name:
3-[4-(4-methoxyphenyl)cyclohexyl]propan-1-ol
InChI:
InChI=1S/C16H24O2/c1-18-16-10-8-15(9-11-16)14-6-4-13(5-7-14)3-2-12-17/h8-11,13-14,17H,2-7,12H2,1H3
InChI Key:
FDNBZUYVSZIAIS-UHFFFAOYSA-N
SMILES:
OCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)OC
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.366g/mol
Monoisotopic Mass:
248.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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