Home Carboxys 4-Fluoro-2-methylindole-3-carboxylic acid ethyl ester

4-Fluoro-2-methylindole-3-carboxylic acid ethyl ester

CAS No.:
886362-68-1
Catalog Number:
AG004A29
Molecular Formula:
C12H12FNO2
Molecular Weight:
221.2276
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$210
- +
1g
97%
1 week
United States
$469
- +
Product Description
Catalog Number:
AG004A29
Chemical Name:
4-Fluoro-2-methylindole-3-carboxylic acid ethyl ester
CAS Number:
886362-68-1
Molecular Formula:
C12H12FNO2
Molecular Weight:
221.2276
MDL Number:
MFCD03839918
IUPAC Name:
ethyl 4-fluoro-2-methyl-1H-indole-3-carboxylate
InChI:
InChI=1S/C12H12FNO2/c1-3-16-12(15)10-7(2)14-9-6-4-5-8(13)11(9)10/h4-6,14H,3H2,1-2H3
InChI Key:
FFLAUZJZZHRPQM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(C)[nH]c2c1c(F)ccc2
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.231g/mol
Monoisotopic Mass:
221.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties