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85631-93-2 | Benzenamine, 5-chloro-2-methoxy-N-nitroso-, potassium salt(1:1)
CAS No: 85631-93-2 Catalog No: AG0050YS MDL No:
Product Description
Catalog Number:
AG0050YS
Chemical Name:
Benzenamine, 5-chloro-2-methoxy-N-nitroso-, potassium salt(1:1)
CAS Number:
85631-93-2
Molecular Formula:
C7H6ClKN2O2
Molecular Weight:
224.6860
IUPAC Name:
potassium;(5-chloro-2-methoxyphenyl)-nitrosoazanide
InChI:
InChI=1S/C7H7ClN2O2.K/c1-12-7-3-2-5(8)4-6(7)9-10-11;/h2-4H,1H3,(H,9,11);/q;+1/p-1
InChI Key:
CYSITZHKMIFAAA-UHFFFAOYSA-M
SMILES:
[N-](c1cc(Cl)ccc1OC)N=O.[K+]
EC Number:
288-043-3
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.975g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.685g/mol
Monoisotopic Mass:
223.975g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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