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29181-50-8 | 2,4-Pyridinedicarbonitrile
CAS No: 29181-50-8 Catalog No: AG002XME MDL No:MFCD00014627
Product Description
Catalog Number:
AG002XME
Chemical Name:
2,4-Pyridinedicarbonitrile
CAS Number:
29181-50-8
Molecular Formula:
C7H3N3
Molecular Weight:
129.1188
MDL Number:
MFCD00014627
IUPAC Name:
pyridine-2,4-dicarbonitrile
InChI:
InChI=1S/C7H3N3/c8-4-6-1-2-10-7(3-6)5-9/h1-3H
InChI Key:
HLAGQMFURMNTLW-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1)C#N
EC Number:
249-492-0
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.033g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.122g/mol
Monoisotopic Mass:
129.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Biotransformation of heterocyclic dinitriles by Rhodococcus erythropolis and fungal nitrilases. | Biotechnology letters 20070701 |
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