Home Nitriles 6-Chloro-1h-indole-5-carbonitrile

6-Chloro-1h-indole-5-carbonitrile

CAS No.:
1423120-66-4
Catalog Number:
AG0034CP
Molecular Formula:
C9H5ClN2
Molecular Weight:
176.6024
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$288
- +
1g
97%
1 week
United States
$663
- +
Product Description
Catalog Number:
AG0034CP
Chemical Name:
6-Chloro-1h-indole-5-carbonitrile
CAS Number:
1423120-66-4
Molecular Formula:
C9H5ClN2
Molecular Weight:
176.6024
MDL Number:
MFCD23706334
IUPAC Name:
6-chloro-1H-indole-5-carbonitrile
InChI:
InChI=1S/C9H5ClN2/c10-8-4-9-6(1-2-12-9)3-7(8)5-11/h1-4,12H
InChI Key:
MRYYCCSCMQNXIG-UHFFFAOYSA-N
SMILES:
N#Cc1cc2cc[nH]c2cc1Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.014g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.603g/mol
Monoisotopic Mass:
176.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties