200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1260796-71-1
1260796-71-1 | 1H-Indole-4-carboxylic acid, 7-chloro-2,3-dihydro-2-oxo-, methyl ester
CAS No: 1260796-71-1 Catalog No: AG000RAK MDL No:
Product Description
Catalog Number:
AG000RAK
Chemical Name:
1H-Indole-4-carboxylic acid, 7-chloro-2,3-dihydro-2-oxo-, methyl ester
CAS Number:
1260796-71-1
Molecular Formula:
C10H8ClNO3
Molecular Weight:
225.6284
IUPAC Name:
methyl 7-chloro-2-oxo-1,3-dihydroindole-4-carboxylate
InChI:
InChI=1S/C10H8ClNO3/c1-15-10(14)5-2-3-7(11)9-6(5)4-8(13)12-9/h2-3H,4H2,1H3,(H,12,13)
InChI Key:
LCCKUFKAFQANTL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c2c1CC(=O)N2)Cl
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.019g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.628g/mol
Monoisotopic Mass:
225.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.