Home Carboxys 1-(3-Cyano-benzyl)-3-formyl-1h-indole-5-carboxylic acid methyl ester

1-(3-Cyano-benzyl)-3-formyl-1h-indole-5-carboxylic acid methyl ester

CAS No.:
925889-73-2
Catalog Number:
AG006GMM
Molecular Formula:
C19H14N2O3
Molecular Weight:
318.3261
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$392
- +
Product Description
Catalog Number:
AG006GMM
Chemical Name:
1-(3-Cyano-benzyl)-3-formyl-1h-indole-5-carboxylic acid methyl ester
CAS Number:
925889-73-2
Molecular Formula:
C19H14N2O3
Molecular Weight:
318.3261
MDL Number:
MFCD08689591
IUPAC Name:
methyl 1-[(3-cyanophenyl)methyl]-3-formylindole-5-carboxylate
InChI:
InChI=1S/C19H14N2O3/c1-24-19(23)15-5-6-18-17(8-15)16(12-22)11-21(18)10-14-4-2-3-13(7-14)9-20/h2-8,11-12H,10H2,1H3
InChI Key:
BDTZUDCWVBUYMI-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)c(C=O)cn2Cc1cccc(c1)C#N
Properties
Complexity:
526  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.1g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.332g/mol
Monoisotopic Mass:
318.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties