Home Carboxys 1-Pentyl-1h-indole-3-carboxylic acid

1-Pentyl-1h-indole-3-carboxylic acid

CAS No.:
727421-73-0
Catalog Number:
AG00FYAM
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$189
- +
5mg
≥98%
1 week
United States
$369
- +
10mg
≥98%
1 week
United States
$543
- +
Product Description
Catalog Number:
AG00FYAM
Chemical Name:
1-Pentyl-1h-indole-3-carboxylic acid
CAS Number:
727421-73-0
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD05859192
IUPAC Name:
1-pentylindole-3-carboxylic acid
InChI:
InChI=1S/C14H17NO2/c1-2-3-6-9-15-10-12(14(16)17)11-7-4-5-8-13(11)15/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,16,17)
InChI Key:
HAPJUNILBCTRIJ-UHFFFAOYSA-N
SMILES:
CCCCCn1cc(c2c1cccc2)C(=O)O
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties