Benzoic acid, 2-hydroxy-5-(1-oxooctyl)-


Chemical Name: Benzoic acid, 2-hydroxy-5-(1-oxooctyl)-
CAS Number: 78418-01-6
Product Number: AG00ICY2(AGN-PC-0MUCK1)
Synonyms:
MDL No:
Molecular Formula: C15H20O4
Molecular Weight: 264.3169

Identification/Properties


Computed Properties
Molecular Weight:
264.321g/mol
XLogP3:
5.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
8
Exact Mass:
264.136g/mol
Monoisotopic Mass:
264.136g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
301
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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