200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 565453-80-7
565453-80-7 | 1H-Pyrrolo[1,2-a]imidazole-6-carbonitrile,2,3-dihydro-3-methyl-2-oxo-(9CI)
CAS No: 565453-80-7 Catalog No: AG00EY1D MDL No:MFCD12924545
Product Description
Catalog Number:
AG00EY1D
Chemical Name:
1H-Pyrrolo[1,2-a]imidazole-6-carbonitrile,2,3-dihydro-3-methyl-2-oxo-(9CI)
CAS Number:
565453-80-7
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD12924545
IUPAC Name:
3-methyl-2-oxo-1,3-dihydropyrrolo[1,2-a]imidazole-6-carbonitrile
InChI:
InChI=1S/C8H7N3O/c1-5-8(12)10-7-2-6(3-9)4-11(5)7/h2,4-5H,1H3,(H,10,12)
InChI Key:
REDXEZJAVOEZAO-UHFFFAOYSA-N
SMILES:
N#Cc1cn2c(c1)NC(=O)C2C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.