Home Nitriles 1,2,5-Trimethyl-1h-pyrrole-3-carbonitrile

1,2,5-Trimethyl-1h-pyrrole-3-carbonitrile

CAS No.:
70319-61-8
Catalog Number:
AG00FD51
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00FD51
Chemical Name:
1,2,5-Trimethyl-1h-pyrrole-3-carbonitrile
CAS Number:
70319-61-8
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
MDL Number:
MFCD11110196
IUPAC Name:
1,2,5-trimethylpyrrole-3-carbonitrile
InChI:
InChI=1S/C8H10N2/c1-6-4-8(5-9)7(2)10(6)3/h4H,1-3H3
InChI Key:
AKQHYJBBIMGELE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(n(c1C)C)C
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.182g/mol
Monoisotopic Mass:
134.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties