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17475-40-0 | Nonanoic acid, phenyl ester
CAS No: 17475-40-0 Catalog No: AG001ZXS MDL No:
Product Description
Catalog Number:
AG001ZXS
Chemical Name:
Nonanoic acid, phenyl ester
CAS Number:
17475-40-0
Molecular Formula:
C15H22O2
Molecular Weight:
234.3340
IUPAC Name:
phenyl nonanoate
InChI:
InChI=1S/C15H22O2/c1-2-3-4-5-6-10-13-15(16)17-14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3
InChI Key:
UHGWBEXBBNLGCZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)Oc1ccccc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.162g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.339g/mol
Monoisotopic Mass:
234.162g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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