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13954-62-6 | Benzenediazonium, 4,4'-(1,2-ethenediyl)bis[3-sulfo-, chloride (1:2)
CAS No: 13954-62-6 Catalog No: AG001B7M MDL No:
Product Description
Catalog Number:
AG001B7M
Chemical Name:
Benzenediazonium, 4,4'-(1,2-ethenediyl)bis[3-sulfo-, chloride (1:2)
CAS Number:
13954-62-6
Molecular Formula:
C14H10Cl2N4O6S2
Molecular Weight:
465.2884
IUPAC Name:
4-[2-(4-diazonio-2-sulfophenyl)ethenyl]-3-sulfobenzenediazonium;dichloride
InChI:
InChI=1S/C14H8N4O6S2.2ClH/c15-17-11-5-3-9(13(7-11)25(19,20)21)1-2-10-4-6-12(18-16)8-14(10)26(22,23)24;;/h1-8H;2*1H
InChI Key:
CZGMTJWJZMXELA-UHFFFAOYSA-N
SMILES:
N#[N+]c1ccc(c(c1)S(=O)(=O)O)C=Cc1ccc(cc1S(=O)(=O)O)[N+]#N.[Cl-].[Cl-]
EC Number:
237-733-2
Properties
Complexity:
783
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
463.942g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
465.276g/mol
Monoisotopic Mass:
463.942g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
182A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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