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823192-32-1 | Benzeneacetic acid, (2R)-2,3-dihydroxypropyl ester
CAS No: 823192-32-1 Catalog No: AG005FDD MDL No:
Product Description
Catalog Number:
AG005FDD
Chemical Name:
Benzeneacetic acid, (2R)-2,3-dihydroxypropyl ester
CAS Number:
823192-32-1
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
[(2R)-2,3-dihydroxypropyl] 2-phenylacetate
InChI:
InChI=1S/C11H14O4/c12-7-10(13)8-15-11(14)6-9-4-2-1-3-5-9/h1-5,10,12-13H,6-8H2/t10-/m1/s1
InChI Key:
CANHRSQDYAGCEB-SNVBAGLBSA-N
SMILES:
OC[C@H](COC(=O)Cc1ccccc1)O
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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