METHANAMINIUM, N,N,N-TRIMETHYL-, SALT WITH 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-4-(4-SULFOPHENYL)AZO-1H-PYRAZOLE-3-CARBOXYLIC ACID (3:1)

CAS No.
131013-81-5
CCD No.
CCD00251434
Formula
C16 H9 N4 O9 S2 . 3 C4 H12 N
MolWeight
687.836

Basic Information

Product Name: METHANAMINIUM, N,N,N-TRIMETHYL-, SALT WITH 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-4-(4-SULFOPHENYL)AZO-1H-PYRAZOLE-3-CARBOXYLIC ACID (3:1)
CAS: 131013-81-5
English Synonyms: METHANAMINIUM, N,N,N-TRIMETHYL-, SALT WITH 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-4-(4-SULFOPHENYL)AZO-1H-PYRAZOLE-3-CARBOXYLIC ACID (3:1)
MDL Number.: MFCD01754726
H bond acceptor: 13
H bond donor: 0
Smile: C[N+](C)(C)C.C[N+](C)(C)C.C[N+](C)(C)C.c1cc(ccc1/N=N/C2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-]
InChi: InChI=1S/C16H12N4O9S2.3C4H12N/c21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29;3*1-5(2,3)4/h1-8,13H,(H,22,23)(H,24,25,26)(H,27,28,29);3*1-4H3/q;3*+1/p-3/b18-17+;;;
InChiKey: InChIKey=WPYDLALKWDHDQN-GLCFPVLVSA-K

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