200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 88089-27-4
88089-27-4 | 2-Propenoic acid, 3-(3-formyl-1H-indol-4-yl)-, methyl ester
CAS No: 88089-27-4 Catalog No: AG004H35 MDL No:
Product Description
Catalog Number:
AG004H35
Chemical Name:
2-Propenoic acid, 3-(3-formyl-1H-indol-4-yl)-, methyl ester
CAS Number:
88089-27-4
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
methyl 3-(3-formyl-1H-indol-4-yl)prop-2-enoate
InChI:
InChI=1S/C13H11NO3/c1-17-12(16)6-5-9-3-2-4-11-13(9)10(8-15)7-14-11/h2-8,14H,1H3
InChI Key:
XDXFYTCKFGFFQA-UHFFFAOYSA-N
SMILES:
COC(=O)C=Cc1cccc2c1c(C=O)c[nH]2
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.235g/mol
Monoisotopic Mass:
229.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.