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4465-44-5 | (S);-Methyl 3-hydroxy-2-(tritylamino);propanoate
CAS No: 4465-44-5 Catalog No: AG003SFV MDL No:MFCD00192570
Product Description
Catalog Number:
AG003SFV
Chemical Name:
(S);-Methyl 3-hydroxy-2-(tritylamino);propanoate
CAS Number:
4465-44-5
Molecular Formula:
C23H23NO3
Molecular Weight:
361.4336
MDL Number:
MFCD00192570
IUPAC Name:
methyl (2S)-3-hydroxy-2-(tritylamino)propanoate
InChI:
InChI=1S/C23H23NO3/c1-27-22(26)21(17-25)24-23(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,24-25H,17H2,1H3/t21-/m0/s1
InChI Key:
LXAWQKKSNNYYEK-NRFANRHFSA-N
SMILES:
OC[C@@H](C(=O)OC)NC(c1ccccc1)(c1ccccc1)c1ccccc1
EC Number:
610-207-3
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
361.168g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.441g/mol
Monoisotopic Mass:
361.168g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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