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95061-51-1 | (S);-2-Hydroxy-1,2,2-triphenylethyl acetate
CAS No: 95061-51-1 Catalog No: AG003AYO MDL No:MFCD00066241
Product Description
Catalog Number:
AG003AYO
Chemical Name:
(S);-2-Hydroxy-1,2,2-triphenylethyl acetate
CAS Number:
95061-51-1
Molecular Formula:
C22H20O3
Molecular Weight:
332.3924
MDL Number:
MFCD00066241
IUPAC Name:
[(1S)-2-hydroxy-1,2,2-triphenylethyl] acetate
InChI:
InChI=1S/C22H20O3/c1-17(23)25-21(18-11-5-2-6-12-18)22(24,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,24H,1H3/t21-/m0/s1
InChI Key:
GXLZCXZLVDUDHP-NRFANRHFSA-N
SMILES:
CC(=O)O[C@H](C(c1ccccc1)(c1ccccc1)O)c1ccccc1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
332.141g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.399g/mol
Monoisotopic Mass:
332.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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