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50744-63-3

50744-63-3 | 5,9-Tridecadienenitrile, 10-propyl-, (Z)-

CAS No: 50744-63-3 Catalog No: AG006W5E MDL No:

Product Description

Catalog Number:
AG006W5E
Chemical Name:
5,9-Tridecadienenitrile, 10-propyl-, (Z)-
CAS Number:
50744-63-3
Molecular Formula:
C16H27N
Molecular Weight:
233.3923
IUPAC Name:
10-propyltrideca-5,9-dienenitrile
InChI:
InChI=1S/C16H27N/c1-3-12-16(13-4-2)14-10-8-6-5-7-9-11-15-17/h5-6,14H,3-4,7-13H2,1-2H3
InChI Key:
JDGCCAQRKWLFOR-UHFFFAOYSA-N
SMILES:
CCCC(=CCC/C=C\CCCC#N)CCC

Properties

Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.214g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.399g/mol
Monoisotopic Mass:
233.214g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.4  

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