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13134-03-7 | Propanedinitrile, 2-(2-methylpropylidene)-
CAS No: 13134-03-7 Catalog No: AG000VZI MDL No:
Product Description
Catalog Number:
AG000VZI
Chemical Name:
Propanedinitrile, 2-(2-methylpropylidene)-
CAS Number:
13134-03-7
Molecular Formula:
C7H8N2
Molecular Weight:
120.1518
IUPAC Name:
2-(2-methylpropylidene)propanedinitrile
InChI:
InChI=1S/C7H8N2/c1-6(2)3-7(4-8)5-9/h3,6H,1-2H3
InChI Key:
QJVQEWMEWWZHHF-UHFFFAOYSA-N
SMILES:
CC(C=C(C#N)C#N)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.069g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
120.155g/mol
Monoisotopic Mass:
120.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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