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139041-11-5

139041-11-5 | 1,4-Pentalenedicarbonitrile, 2,3,5,6-tetrahydro-

CAS No: 139041-11-5 Catalog No: AG001A30 MDL No:

Product Description

Catalog Number:
AG001A30
Chemical Name:
1,4-Pentalenedicarbonitrile, 2,3,5,6-tetrahydro-
CAS Number:
139041-11-5
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
IUPAC Name:
2,3,5,6-tetrahydropentalene-1,4-dicarbonitrile
InChI:
InChI=1S/C10H8N2/c11-5-7-1-3-9-8(6-12)2-4-10(7)9/h1-4H2
InChI Key:
GGXJQAMGIBNAJD-UHFFFAOYSA-N
SMILES:
N#CC1=C2CCC(=C2CC1)C#N

Properties

Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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