200,000+ products from a single source!
sales@angenechem.com
122613-33-6 | Propanedinitrile, 2-[3-(dimethylamino)-2-(4-pyridinyl)-2-propen-1-ylidene]-
CAS No: 122613-33-6 Catalog No: AG0017JH MDL No:
Product Description
Catalog Number:
AG0017JH
Chemical Name:
Propanedinitrile, 2-[3-(dimethylamino)-2-(4-pyridinyl)-2-propen-1-ylidene]-
CAS Number:
122613-33-6
Molecular Formula:
C13H12N4
Molecular Weight:
224.2612
IUPAC Name:
2-[3-(dimethylamino)-2-pyridin-4-ylprop-2-enylidene]propanedinitrile
InChI:
InChI=1S/C13H12N4/c1-17(2)10-13(7-11(8-14)9-15)12-3-5-16-6-4-12/h3-7,10H,1-2H3
InChI Key:
MMLMEECXZDRMKF-UHFFFAOYSA-N
SMILES:
N#CC(=CC(=CN(C)C)c1ccncc1)C#N
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.267g/mol
Monoisotopic Mass:
224.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.