BLACK NO 2

CAS No.
2118-39-0
CCD No.
CCD00337882
Formula
C26 H15 N5 O13 S4 . 4 Na
MolWeight
825.651

Basic Information

Product Name: BLACK NO 2
CAS: 2118-39-0
English Synonyms: FOOD BLACK 2 ; BLACK NO 2
MDL Number.: MFCD02752594
H bond acceptor: 18
H bond donor: 2
Smile: c1cc(ccc1/N=N/c2ccc(c3c2ccc(c3)S(=O)(=O)[O-])/N=N/c4c(cc5cc(c(cc5c4O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
InChi: InChI=1S/C26H19N5O13S4.4Na/c27-20-12-18-13(9-23(20)47(39,40)41)10-24(48(42,43)44)25(26(18)32)31-30-22-8-7-21(17-6-5-16(11-19(17)22)46(36,37)38)29-28-14-1-3-15(4-2-14)45(33,34)35;;;;/h1-12,32H,27H2,(H,33,34,35)(H,36,37,38)(H,39,40,41)(H,42,43,44);;;;/q;4*+1/p-4/b29-28+,31-30+;;;;
InChiKey: InChIKey=BZJNMKDNHPKBHE-IDOXDSHBSA-J

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