Home Other Building Blocks 5-FLUORO-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID

5-FLUORO-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID

CAS No.:
50536-62-4
Catalog Number:
AG01DWGI
Molecular Formula:
C10H8FNO2
Molecular Weight:
193.1744
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Product Description
Catalog Number:
AG01DWGI
Chemical Name:
5-FLUORO-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID
CAS Number:
50536-62-4
Molecular Formula:
C10H8FNO2
Molecular Weight:
193.1744
MDL Number:
MFCD20642374
IUPAC Name:
5-fluoro-4-methyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C10H8FNO2/c1-5-6-4-9(10(13)14)12-8(6)3-2-7(5)11/h2-4,12H,1H3,(H,13,14)
InChI Key:
VYRUSCDHMAEATM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)ccc(c2C)F
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.054g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.177g/mol
Monoisotopic Mass:
193.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties