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70288-90-3 | benzenesulfonic acid, 3-amino-2,4,6-trichloro-5-(hydrazinomethyl)-
CAS No: 70288-90-3 Catalog No: AG005KDG MDL No:
Product Description
Catalog Number:
AG005KDG
Chemical Name:
benzenesulfonic acid, 3-amino-2,4,6-trichloro-5-(hydrazinomethyl)-
CAS Number:
70288-90-3
Molecular Formula:
C7H8Cl3N3O3S
Molecular Weight:
320.5807
IUPAC Name:
3-amino-2,4,6-trichloro-5-(hydrazinylmethyl)benzenesulfonic acid
InChI:
InChI=1S/C7H8Cl3N3O3S/c8-3-2(1-13-12)4(9)7(17(14,15)16)5(10)6(3)11/h13H,1,11-12H2,(H,14,15,16)
InChI Key:
VFPGZQFWRZZSIE-UHFFFAOYSA-N
SMILES:
NNCc1c(Cl)c(N)c(c(c1Cl)S(=O)(=O)O)Cl
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.935g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
320.569g/mol
Monoisotopic Mass:
318.935g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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