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137226-13-2 | 2-Decanol, 1-(phenylmethoxy)-
CAS No: 137226-13-2 Catalog No: AG0012Z7 MDL No:
Product Description
Catalog Number:
AG0012Z7
Chemical Name:
2-Decanol, 1-(phenylmethoxy)-
CAS Number:
137226-13-2
Molecular Formula:
C17H28O2
Molecular Weight:
264.4030
IUPAC Name:
1-phenylmethoxydecan-2-ol
InChI:
InChI=1S/C17H28O2/c1-2-3-4-5-6-10-13-17(18)15-19-14-16-11-8-7-9-12-16/h7-9,11-12,17-18H,2-6,10,13-15H2,1H3
InChI Key:
MHVVPWPYSVXDMW-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(COCc1ccccc1)O
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.209g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.409g/mol
Monoisotopic Mass:
264.209g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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