3-(2,4-DINITRO-PHENYLAMINO)-BENZOIC ACID

CAS No.
7221-25-2
CCD No.
CCD08039093
Formula
C13 H9 N3 O6
MolWeight
303.229

Basic Information

Product Name: 3-(2,4-DINITRO-PHENYLAMINO)-BENZOIC ACID
CAS: 7221-25-2
English Synonyms: N-(3-CARBOXYPHENYL)-2,4-DINITROANILINE ; 3-(2,4-DINITRO-PHENYLAMINO)-BENZOIC ACID ; BENZOIC ACID, 3-[(2,4-DINITROPHENYL)AMINO]-
MDL Number.: MFCD00405155
H bond acceptor: 9
H bond donor: 2
Smile: c1cc(cc(c1)Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=O)O
InChi: InChI=1S/C13H9N3O6/c17-13(18)8-2-1-3-9(6-8)14-11-5-4-10(15(19)20)7-12(11)16(21)22/h1-7,14H,(H,17,18)
InChiKey: InChIKey=IXLRLXCTHVMJJM-UHFFFAOYSA-N

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