Home Carboxys 5,7-difluoro-3-methyl-1H-indole-2-carboxylic acid

5,7-difluoro-3-methyl-1H-indole-2-carboxylic acid

CAS No.:
1785399-14-5
Catalog Number:
AG01BO5H
Molecular Formula:
C10H7F2NO2
Molecular Weight:
211.1649
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Product Description
Catalog Number:
AG01BO5H
Chemical Name:
5,7-difluoro-3-methyl-1H-indole-2-carboxylic acid
CAS Number:
1785399-14-5
Molecular Formula:
C10H7F2NO2
Molecular Weight:
211.1649
MDL Number:
MFCD30498733
IUPAC Name:
5,7-difluoro-3-methyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C10H7F2NO2/c1-4-6-2-5(11)3-7(12)9(6)13-8(4)10(14)15/h2-3,13H,1H3,(H,14,15)
InChI Key:
RUTGKPKMHWIMFA-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c2c(c1)c(C)c([nH]2)C(=O)O
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.168g/mol
Monoisotopic Mass:
211.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties