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Home > Nitro Compounds > 10098-38-1
10098-38-1 | b-Hydroxy-4-nitro-phenylalanine
CAS No: 10098-38-1 Catalog No: AG00JNWW MDL No:
Product Description
Catalog Number:
AG00JNWW
Chemical Name:
b-Hydroxy-4-nitro-phenylalanine
CAS Number:
10098-38-1
IUPAC Name:
2-amino-3-hydroxy-3-(4-nitrophenyl)propanoic acid
InChI:
InChI=1S/C9H10N2O5/c10-7(9(13)14)8(12)5-1-3-6(4-2-5)11(15)16/h1-4,7-8,12H,10H2,(H,13,14)
InChI Key:
MDMLHLZJIBYSKV-UHFFFAOYSA-N
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
226.188g/mol
Monoisotopic Mass:
226.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.7
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