Home Carboxys 4-Cyano-1h-indole-6-carboxylic acid

4-Cyano-1h-indole-6-carboxylic acid

CAS No.:
1427502-44-0
Catalog Number:
AG00HWMH
Molecular Formula:
C10H6N2O2
Molecular Weight:
186.1668
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HWMH
Chemical Name:
4-Cyano-1h-indole-6-carboxylic acid
CAS Number:
1427502-44-0
Molecular Formula:
C10H6N2O2
Molecular Weight:
186.1668
MDL Number:
MFCD23704066
IUPAC Name:
4-cyano-1H-indole-6-carboxylic acid
InChI:
InChI=1S/C10H6N2O2/c11-5-7-3-6(10(13)14)4-9-8(7)1-2-12-9/h1-4,12H,(H,13,14)
InChI Key:
UEYYLWAXGUNAKY-UHFFFAOYSA-N
SMILES:
N#Cc1cc(cc2c1cc[nH]2)C(=O)O
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.043g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.17g/mol
Monoisotopic Mass:
186.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties