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Home > Nitro Compounds > 1655-64-7
1655-64-7 | L-Serine, N-(2,4-dinitrophenyl)-
CAS No: 1655-64-7 Catalog No: AG001W6D MDL No:MFCD00038098
Product Description
Catalog Number:
AG001W6D
Chemical Name:
L-Serine, N-(2,4-dinitrophenyl)-
CAS Number:
1655-64-7
Molecular Formula:
C9H9N3O7
Molecular Weight:
271.1837
MDL Number:
MFCD00038098
IUPAC Name:
(2S)-2-(2,4-dinitroanilino)-3-hydroxypropanoic acid
InChI:
InChI=1S/C9H9N3O7/c13-4-7(9(14)15)10-6-2-1-5(11(16)17)3-8(6)12(18)19/h1-3,7,10,13H,4H2,(H,14,15)/t7-/m0/s1
InChI Key:
SBQZBOCQYMVLTC-ZETCQYMHSA-N
SMILES:
OC[C@@H](C(=O)O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
EC Number:
216-745-1
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
271.044g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
271.185g/mol
Monoisotopic Mass:
271.044g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
161A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Binding induced conformational changes of proteins correlate with their intrinsic fluctuations: a case study of antibodies. | BMC structural biology 20070101 |
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