Home Other Building Blocks 1H-INDOLE-5-CARBONITRILE,3-METHYL-

1H-INDOLE-5-CARBONITRILE,3-METHYL-

CAS No.:
3613-06-7
Catalog Number:
AG00CN2Z
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00CN2Z
Chemical Name:
1H-INDOLE-5-CARBONITRILE,3-METHYL-
CAS Number:
3613-06-7
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD15523476
IUPAC Name:
3-methyl-1H-indole-5-carbonitrile
InChI:
InChI=1S/C10H8N2/c1-7-6-12-10-3-2-8(5-11)4-9(7)10/h2-4,6,12H,1H3
InChI Key:
LENPHOSQASNAFC-UHFFFAOYSA-N
SMILES:
Cc1c[nH]c2c1cc(cc2)C#N
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties