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

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

CAS No.:
166747-91-7
Catalog Number:
AG001WX1
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG001WX1
Chemical Name:
2-(3-Formyl-1H-indol-1-yl)propanoic acid
CAS Number:
166747-91-7
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD03167983
IUPAC Name:
2-(3-formylindol-1-yl)propanoic acid
InChI:
InChI=1S/C12H11NO3/c1-8(12(15)16)13-6-9(7-14)10-4-2-3-5-11(10)13/h2-8H,1H3,(H,15,16)
InChI Key:
ZINMANYXDFLPES-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2)C(C(=O)O)C
Properties
Complexity:
292  
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:
3  
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties