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119363-63-2 | Phenylalanine, N-[(1,1-dimethylethoxy)carbonyl]-β-phenyl-
CAS No: 119363-63-2 Catalog No: AG000INK MDL No:MFCD00797562
Product Description
Catalog Number:
AG000INK
Chemical Name:
Phenylalanine, N-[(1,1-dimethylethoxy)carbonyl]-β-phenyl-
CAS Number:
119363-63-2
Molecular Formula:
C20H23NO4
Molecular Weight:
341.4009
MDL Number:
MFCD00797562
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,3-diphenylpropanoic acid
InChI:
InChI=1S/C20H23NO4/c1-20(2,3)25-19(24)21-17(18(22)23)16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16-17H,1-3H3,(H,21,24)(H,22,23)
InChI Key:
TYJDOLCFYZSNQC-UHFFFAOYSA-N
SMILES:
OC(=O)[C@H](C(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.163g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.407g/mol
Monoisotopic Mass:
341.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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