200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 132725-41-8
132725-41-8 | 2-[(1,3-dimethyl-1H-indol-2-yl)methyl]benzoic acid
CAS No: 132725-41-8 Catalog No: AG01F8ZH MDL No:
Product Description
Catalog Number:
AG01F8ZH
Chemical Name:
2-[(1,3-dimethyl-1H-indol-2-yl)methyl]benzoic acid
CAS Number:
132725-41-8
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
2-[(1,3-dimethylindol-2-yl)methyl]benzoic acid
InChI:
InChI=1S/C18H17NO2/c1-12-14-8-5-6-10-16(14)19(2)17(12)11-13-7-3-4-9-15(13)18(20)21/h3-10H,11H2,1-2H3,(H,20,21)
InChI Key:
ISKRUCYCGQIBLH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1Cc1c(C)c2c(n1C)cccc2
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.