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89820-51-9 | Benzenemethanol, 2-(cyclohexyloxy)-, acetate
CAS No: 89820-51-9 Catalog No: AG003Z63 MDL No:
Product Description
Catalog Number:
AG003Z63
Chemical Name:
Benzenemethanol, 2-(cyclohexyloxy)-, acetate
CAS Number:
89820-51-9
Molecular Formula:
C15H22O4
Molecular Weight:
266.3328
IUPAC Name:
acetic acid;(2-cyclohexyloxyphenyl)methanol
InChI:
InChI=1S/C13H18O2.C2H4O2/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12;1-2(3)4/h4-6,9,12,14H,1-3,7-8,10H2;1H3,(H,3,4)
InChI Key:
DBCITYVYORXMAY-UHFFFAOYSA-N
SMILES:
CC(=O)O.OCc1ccccc1OC1CCCCC1
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.337g/mol
Monoisotopic Mass:
266.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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