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138950-53-5 | Propanedinitrile, 2-pentadecyl-
CAS No: 138950-53-5 Catalog No: AG0019WL MDL No:
Product Description
Catalog Number:
AG0019WL
Chemical Name:
Propanedinitrile, 2-pentadecyl-
CAS Number:
138950-53-5
Molecular Formula:
C18H32N2
Molecular Weight:
276.4601
IUPAC Name:
2-pentadecylpropanedinitrile
InChI:
InChI=1S/C18H32N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(16-19)17-20/h18H,2-15H2,1H3
InChI Key:
NVEKWNIASZWSJU-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(C#N)C#N
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.257g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.468g/mol
Monoisotopic Mass:
276.257g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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