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Home > Nitro Compounds > 32988-39-9
32988-39-9 | D-Tyrosine, 3-nitro-
CAS No: 32988-39-9 Catalog No: AG00I6BU MDL No:MFCD02684446
Product Description
Catalog Number:
AG00I6BU
Chemical Name:
D-Tyrosine, 3-nitro-
CAS Number:
32988-39-9
Molecular Formula:
C9H10N2O5
Molecular Weight:
226.1861
MDL Number:
MFCD02684446
IUPAC Name:
(2R)-2-amino-3-(4-hydroxy-3-nitrophenyl)propanoic acid
InChI:
InChI=1S/C9H10N2O5/c10-6(9(13)14)3-5-1-2-8(12)7(4-5)11(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)/t6-/m1/s1
InChI Key:
FBTSQILOGYXGMD-ZCFIWIBFSA-N
SMILES:
OC(=O)[C@@H](Cc1ccc(c(c1)[N+](=O)[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:
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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