Home Halogens 5-bromo-7-methyl-1H-indazole-3-carboxylic acid

5-bromo-7-methyl-1H-indazole-3-carboxylic acid

CAS No.:
1360962-29-3
Catalog Number:
AG01B2LQ
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
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Product Description
Catalog Number:
AG01B2LQ
Chemical Name:
5-bromo-7-methyl-1H-indazole-3-carboxylic acid
CAS Number:
1360962-29-3
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
MDL Number:
MFCD07378927
IUPAC Name:
5-bromo-7-methyl-2H-indazole-3-carboxylic acid
InChI:
InChI=1S/C9H7BrN2O2/c1-4-2-5(10)3-6-7(4)11-12-8(6)9(13)14/h2-3H,1H3,(H,11,12)(H,13,14)
InChI Key:
ZDVRSACZEUSLSI-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c2c(c1)c(n[nH]2)C(=O)O
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties