200,000+ products from a single source!
sales@angenechem.com
23659-85-0 | 1H-Indole-3-carboxylic acid, 2,3-dihydro-3-hydroxy-4,6-dimethoxy-2-oxo-, ethyl ester
CAS No: 23659-85-0 Catalog No: AG002O1M MDL No:MFCD00115004
Product Description
Catalog Number:
AG002O1M
Chemical Name:
1H-Indole-3-carboxylic acid, 2,3-dihydro-3-hydroxy-4,6-dimethoxy-2-oxo-, ethyl ester
CAS Number:
23659-85-0
Molecular Formula:
C13H15NO6
Molecular Weight:
281.2613
MDL Number:
MFCD00115004
IUPAC Name:
ethyl 3-hydroxy-4,6-dimethoxy-2-oxo-1H-indole-3-carboxylate
InChI:
InChI=1S/C13H15NO6/c1-4-20-12(16)13(17)10-8(14-11(13)15)5-7(18-2)6-9(10)19-3/h5-6,17H,4H2,1-3H3,(H,14,15)
InChI Key:
PCCZQYRIWLXVNZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(O)C(=O)Nc2c1c(OC)cc(c2)OC
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.264g/mol
Monoisotopic Mass:
281.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
94.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.