Home Other Building Blocks 3-(2-Formyl-1H-indol-1-yl)propanoic acid

3-(2-Formyl-1H-indol-1-yl)propanoic acid

CAS No.:
1438805-05-0
Catalog Number:
AG001IJA
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$236
- +
250mg
95%
In Stock USA
United States
$441
- +
Product Description
Catalog Number:
AG001IJA
Chemical Name:
3-(2-Formyl-1H-indol-1-yl)propanoic acid
CAS Number:
1438805-05-0
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD30183565
IUPAC Name:
3-(2-formylindol-1-yl)propanoic acid
InChI:
InChI=1S/C12H11NO3/c14-8-10-7-9-3-1-2-4-11(9)13(10)6-5-12(15)16/h1-4,7-8H,5-6H2,(H,15,16)
InChI Key:
XJWRORSJFWYSEF-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c(n1CCC(=O)O)cccc2
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties