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1000341-15-0

1000341-15-0 | 1H-Indazole, 3-chloro-6-methoxy-4-nitro-

CAS No: 1000341-15-0 Catalog No: AG0000FY MDL No:

Product Description

Catalog Number:
AG0000FY
Chemical Name:
1H-Indazole, 3-chloro-6-methoxy-4-nitro-
CAS Number:
1000341-15-0
Molecular Formula:
C8H6ClN3O3
Molecular Weight:
227.6045
IUPAC Name:
3-chloro-6-methoxy-4-nitro-2H-indazole
InChI:
InChI=1S/C8H6ClN3O3/c1-15-4-2-5-7(8(9)11-10-5)6(3-4)12(13)14/h2-3H,1H3,(H,10,11)
InChI Key:
XWZNSOKZWXMKTD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(OC)cc2c1c(Cl)n[nH]2

Properties

Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.01g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.604g/mol
Monoisotopic Mass:
227.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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