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1167056-25-8

1167056-25-8 | 1H-Indazole, 3,4-dichloro-5-methoxy-

CAS No: 1167056-25-8 Catalog No: AG000D3H MDL No:

Product Description

Catalog Number:
AG000D3H
Chemical Name:
1H-Indazole, 3,4-dichloro-5-methoxy-
CAS Number:
1167056-25-8
Molecular Formula:
C8H6Cl2N2O
Molecular Weight:
217.0520
IUPAC Name:
3,4-dichloro-5-methoxy-2H-indazole
InChI:
InChI=1S/C8H6Cl2N2O/c1-13-5-3-2-4-6(7(5)9)8(10)12-11-4/h2-3H,1H3,(H,11,12)
InChI Key:
HTQHAYMVFKSVCI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1Cl)c(Cl)n[nH]2

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.986g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.049g/mol
Monoisotopic Mass:
215.986g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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