200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 202003-77-8
202003-77-8 | Benzoic acid, 4-(1H-indol-3-yl)-, ethyl ester
CAS No: 202003-77-8 Catalog No: AG0027ZN MDL No:
Product Description
Catalog Number:
AG0027ZN
Chemical Name:
Benzoic acid, 4-(1H-indol-3-yl)-, ethyl ester
CAS Number:
202003-77-8
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
ethyl 4-(1H-indol-3-yl)benzoate
InChI:
InChI=1S/C17H15NO2/c1-2-20-17(19)13-9-7-12(8-10-13)15-11-18-16-6-4-3-5-14(15)16/h3-11,18H,2H2,1H3
InChI Key:
YQLUNZBSPBTVNS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)c1c[nH]c2c1cccc2
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.