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102410-65-1 | Benzeneacetic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (αS)-
CAS No: 102410-65-1 Catalog No: AG0007ES MDL No:MFCD00155632
Product Description
Catalog Number:
AG0007ES
Chemical Name:
Benzeneacetic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (αS)-
CAS Number:
102410-65-1
Molecular Formula:
C23H19NO4
Molecular Weight:
373.4013
MDL Number:
MFCD00155632
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-phenylacetic acid
InChI:
InChI=1S/C23H19NO4/c25-22(26)21(15-8-2-1-3-9-15)24-23(27)28-14-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)20/h1-13,20-21H,14H2,(H,24,27)(H,25,26)/t21-/m0/s1
InChI Key:
PCJHOCNJLMFYCV-NRFANRHFSA-N
SMILES:
O=C(N[C@@H](c1ccccc1)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
373.131g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
373.408g/mol
Monoisotopic Mass:
373.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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