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14164-26-2 | Propanedinitrile, 2-[1-(dimethylamino)ethylidene]-
CAS No: 14164-26-2 Catalog No: AG001GS2 MDL No:MFCD09835079
Product Description
Catalog Number:
AG001GS2
Chemical Name:
Propanedinitrile, 2-[1-(dimethylamino)ethylidene]-
CAS Number:
14164-26-2
Molecular Formula:
C7H9N3
Molecular Weight:
135.1665
MDL Number:
MFCD09835079
IUPAC Name:
2-[1-(dimethylamino)ethylidene]propanedinitrile
InChI:
InChI=1S/C7H9N3/c1-6(10(2)3)7(4-8)5-9/h1-3H3
InChI Key:
DOBZLWPTHVTUCH-UHFFFAOYSA-N
SMILES:
N#CC(=C(N(C)C)C)C#N
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.08g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.17g/mol
Monoisotopic Mass:
135.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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