Home Carboxys 6-Chloro-4-indazolecarboxylic acid Methyl ester

6-Chloro-4-indazolecarboxylic acid Methyl ester

CAS No.:
885519-72-2
Catalog Number:
AG00H34S
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
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Product Description
Catalog Number:
AG00H34S
Chemical Name:
6-Chloro-4-indazolecarboxylic acid Methyl ester
CAS Number:
885519-72-2
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
MDL Number:
MFCD07781390
IUPAC Name:
methyl 6-chloro-1H-indazole-4-carboxylate
InChI:
InChI=1S/C9H7ClN2O2/c1-14-9(13)6-2-5(10)3-8-7(6)4-11-12-8/h2-4H,1H3,(H,11,12)
InChI Key:
SBYBKVQDMAREOM-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)cc2c1cn[nH]2
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties