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1000342-50-6 | 1H-Indazol-5-amine, 6-chloro-3-iodo-
CAS No: 1000342-50-6 Catalog No: AG0000JJ MDL No:
Product Description
Catalog Number:
AG0000JJ
Chemical Name:
1H-Indazol-5-amine, 6-chloro-3-iodo-
CAS Number:
1000342-50-6
Molecular Formula:
C7H5ClIN3
Molecular Weight:
293.4922
IUPAC Name:
6-chloro-3-iodo-2H-indazol-5-amine
InChI:
InChI=1S/C7H5ClIN3/c8-4-2-6-3(1-5(4)10)7(9)12-11-6/h1-2H,10H2,(H,11,12)
InChI Key:
LNTSOWANOHXTLS-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]nc(c2cc1N)I
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.922g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.492g/mol
Monoisotopic Mass:
292.922g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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