Home Nitriles 3-(4-Chlorobutyl)-1h-indole-5-carbonitrile

3-(4-Chlorobutyl)-1h-indole-5-carbonitrile

CAS No.:
143612-79-7
Catalog Number:
AG00ACPS
Molecular Formula:
C13H13ClN2
Molecular Weight:
232.7087
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
98%(HPLC)
In Stock USA
United States
$87
- +
100mg
98%(HPLC)
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG00ACPS
Chemical Name:
3-(4-Chlorobutyl)-1h-indole-5-carbonitrile
CAS Number:
143612-79-7
Molecular Formula:
C13H13ClN2
Molecular Weight:
232.7087
MDL Number:
MFCD09833261
IUPAC Name:
3-(4-chlorobutyl)-1H-indole-5-carbonitrile
InChI:
InChI=1S/C13H13ClN2/c14-6-2-1-3-11-9-16-13-5-4-10(8-15)7-12(11)13/h4-5,7,9,16H,1-3,6H2
InChI Key:
NJJWMEJWFYRORL-UHFFFAOYSA-N
SMILES:
ClCCCCc1c[nH]c2c1cc(cc2)C#N
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.077g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.711g/mol
Monoisotopic Mass:
232.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties