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158691-83-9 | L-Serine, O-[(2-nitrophenyl)methyl]-
CAS No: 158691-83-9 Catalog No: AG001QR9 MDL No:
Product Description
Catalog Number:
AG001QR9
Chemical Name:
L-Serine, O-[(2-nitrophenyl)methyl]-
CAS Number:
158691-83-9
Molecular Formula:
C10H12N2O5
Molecular Weight:
240.2127
IUPAC Name:
(2S)-2-amino-3-[(2-nitrophenyl)methoxy]propanoic acid
InChI:
InChI=1S/C10H12N2O5/c11-8(10(13)14)6-17-5-7-3-1-2-4-9(7)12(15)16/h1-4,8H,5-6,11H2,(H,13,14)/t8-/m0/s1
InChI Key:
VTERJWKRLSSHIC-QMMMGPOBSA-N
SMILES:
OC(=O)[C@H](COCc1ccccc1[N+](=O)[O-])N
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
240.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.215g/mol
Monoisotopic Mass:
240.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
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