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3695-98-5 | 1,1,3,3-Propanetetracarbonitrile
CAS No: 3695-98-5 Catalog No: AG003D6F MDL No:
Product Description
Catalog Number:
AG003D6F
Chemical Name:
1,1,3,3-Propanetetracarbonitrile
CAS Number:
3695-98-5
IUPAC Name:
propane-1,1,3,3-tetracarbonitrile
InChI:
InChI=1S/C7H4N4/c8-2-6(3-9)1-7(4-10)5-11/h6-7H,1H2
InChI Key:
QHNAZGXMVZNHLI-UHFFFAOYSA-N
NSC Number:
44362
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.044g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.137g/mol
Monoisotopic Mass:
144.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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