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99287-97-5 | Phenethyl 3-hydroxybenzoate
CAS No: 99287-97-5 Catalog No: AG01FOBF MDL No:
Product Description
Catalog Number:
AG01FOBF
Chemical Name:
Phenethyl 3-hydroxybenzoate
CAS Number:
99287-97-5
IUPAC Name:
2-phenylethyl 3-hydroxybenzoate
InChI:
InChI=1S/C15H14O3/c16-14-8-4-7-13(11-14)15(17)18-10-9-12-5-2-1-3-6-12/h1-8,11,16H,9-10H2
InChI Key:
PCFBUQIVFWSZBX-UHFFFAOYSA-N
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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