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Home > Nitro Compounds > 1602-42-2
1602-42-2 | L-Arginine, N2-(2,4-dinitrophenyl)-
CAS No: 1602-42-2 Catalog No: AG001RRG MDL No:MFCD00038105
Product Description
Catalog Number:
AG001RRG
Chemical Name:
L-Arginine, N2-(2,4-dinitrophenyl)-
CAS Number:
1602-42-2
Molecular Formula:
C12H16N6O6
Molecular Weight:
340.2920
MDL Number:
MFCD00038105
IUPAC Name:
(2S)-5-(diaminomethylideneamino)-2-(2,4-dinitroanilino)pentanoic acid
InChI:
InChI=1S/C12H16N6O6/c13-12(14)15-5-1-2-9(11(19)20)16-8-4-3-7(17(21)22)6-10(8)18(23)24/h3-4,6,9,16H,1-2,5H2,(H,19,20)(H4,13,14,15)/t9-/m0/s1
InChI Key:
GZJXZYUXRVBOAH-VIFPVBQESA-N
SMILES:
NC(=N)NCCC[C@@H](C(=O)O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
EC Number:
216-497-4
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
340.113g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
340.296g/mol
Monoisotopic Mass:
340.113g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
205A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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