Home Other Building Blocks 3-(2,3-dihydro-1H-indol-1-yl)butanoic acid

3-(2,3-dihydro-1H-indol-1-yl)butanoic acid

CAS No.:
1154981-64-2
Catalog Number:
AG01C4GL
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01C4GL
Chemical Name:
3-(2,3-dihydro-1H-indol-1-yl)butanoic acid
CAS Number:
1154981-64-2
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD12132088
IUPAC Name:
3-(2,3-dihydroindol-1-yl)butanoic acid
InChI:
InChI=1S/C12H15NO2/c1-9(8-12(14)15)13-7-6-10-4-2-3-5-11(10)13/h2-5,9H,6-8H2,1H3,(H,14,15)
InChI Key:
UPZNECUMVLUHKW-UHFFFAOYSA-N
SMILES:
OC(=O)CC(N1CCc2c1cccc2)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties