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26509-71-7 | 3,6-Octadienenitrile, 3,7-dimethyl-, (3E)-
CAS No: 26509-71-7 Catalog No: AG002THH MDL No:
Product Description
Catalog Number:
AG002THH
Chemical Name:
3,6-Octadienenitrile, 3,7-dimethyl-, (3E)-
CAS Number:
26509-71-7
Molecular Formula:
C10H15N
Molecular Weight:
149.2328
IUPAC Name:
3,7-dimethylocta-3,6-dienenitrile
InChI:
InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5-6H,4,7H2,1-3H3
InChI Key:
LNWFHUTYUOYNBG-UHFFFAOYSA-N
SMILES:
N#CC/C(=C/CC=C(C)C)/C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.237g/mol
Monoisotopic Mass:
149.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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