Benzeneacetic acid, a-hydroxy-, phenylmethyl ester, (aS)-


Chemical Name: Benzeneacetic acid, a-hydroxy-, phenylmethyl ester, (aS)-
CAS Number: 62173-99-3
Product Number: AG003R6Q(AGN-PC-0T37HO)
Synonyms:
MDL No:
Molecular Formula: C15H14O3
Molecular Weight: 242.2699

Identification/Properties


Properties
MP:
107 °C
BP:
386.8°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
34 ° (C=1, CH3CN)
Computed Properties
Molecular Weight:
242.274g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
242.094g/mol
Monoisotopic Mass:
242.094g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
253
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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