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88364-67-4 | 5-Heptenenitrile, 3-(1-methylethenyl)-, (Z)-
CAS No: 88364-67-4 Catalog No: AG004MUX MDL No:
Product Description
Catalog Number:
AG004MUX
Chemical Name:
5-Heptenenitrile, 3-(1-methylethenyl)-, (Z)-
CAS Number:
88364-67-4
Molecular Formula:
C10H15N
Molecular Weight:
149.2328
IUPAC Name:
3-prop-1-en-2-ylhept-5-enenitrile
InChI:
InChI=1S/C10H15N/c1-4-5-6-10(7-8-11)9(2)3/h4-5,10H,2,6-7H2,1,3H3
InChI Key:
CCLLGVULJMUKEL-UHFFFAOYSA-N
SMILES:
CC(=C)C(CC#N)C/C=C\C
Properties
Complexity:
192
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:
4
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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