Home Other Building Blocks ETHYL 5-CHLORO-6-FLUORO-1H-INDOLE-2-CARBOXYLATE

ETHYL 5-CHLORO-6-FLUORO-1H-INDOLE-2-CARBOXYLATE

CAS No.:
473257-60-2
Catalog Number:
AG01DLBV
Molecular Formula:
C11H9ClFNO2
Molecular Weight:
241.6461
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Product Description
Catalog Number:
AG01DLBV
Chemical Name:
ETHYL 5-CHLORO-6-FLUORO-1H-INDOLE-2-CARBOXYLATE
CAS Number:
473257-60-2
Molecular Formula:
C11H9ClFNO2
Molecular Weight:
241.6461
MDL Number:
MFCD03094956
IUPAC Name:
ethyl 5-chloro-6-fluoro-1H-indole-2-carboxylate
InChI:
InChI=1S/C11H9ClFNO2/c1-2-16-11(15)10-4-6-3-7(12)8(13)5-9(6)14-10/h3-5,14H,2H2,1H3
InChI Key:
BSVBMPOMIIWULL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]c2c(c1)cc(c(c2)F)Cl
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.031g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.646g/mol
Monoisotopic Mass:
241.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties