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1000340-69-1

1000340-69-1 | 1H-Indazole-3-carboxylic acid, 4-chloro-7-methyl-

CAS No: 1000340-69-1 Catalog No: AG0000EF MDL No:

Product Description

Catalog Number:
AG0000EF
Chemical Name:
1H-Indazole-3-carboxylic acid, 4-chloro-7-methyl-
CAS Number:
1000340-69-1
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
IUPAC Name:
4-chloro-7-methyl-2H-indazole-3-carboxylic acid
InChI:
InChI=1S/C9H7ClN2O2/c1-4-2-3-5(10)6-7(4)11-12-8(6)9(13)14/h2-3H,1H3,(H,11,12)(H,13,14)
InChI Key:
MXVUGWUWTUHGPV-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c2c1c(Cl)ccc2C

Properties

Complexity:
249  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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