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88365-47-3 | 2-Hexenenitrile, 2-(diethylamino)-, (Z)-
CAS No: 88365-47-3 Catalog No: AG004MPD MDL No:
Product Description
Catalog Number:
AG004MPD
Chemical Name:
2-Hexenenitrile, 2-(diethylamino)-, (Z)-
CAS Number:
88365-47-3
Molecular Formula:
C10H18N2
Molecular Weight:
166.2633
IUPAC Name:
2-(diethylamino)hex-2-enenitrile
InChI:
InChI=1S/C10H18N2/c1-4-7-8-10(9-11)12(5-2)6-3/h8H,4-7H2,1-3H3
InChI Key:
FAIVHYQFGPGDPQ-UHFFFAOYSA-N
SMILES:
CCC/C=C(\N(CC)CC)/C#N
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.147g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.268g/mol
Monoisotopic Mass:
166.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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