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19124-16-4 | 2-Pentenenitrile, 4-methyl-, (2Z)-
CAS No: 19124-16-4 Catalog No: AG002F54 MDL No:
Product Description
Catalog Number:
AG002F54
Chemical Name:
2-Pentenenitrile, 4-methyl-, (2Z)-
CAS Number:
19124-16-4
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
IUPAC Name:
(Z)-4-methylpent-2-enenitrile
InChI:
InChI=1S/C6H9N/c1-6(2)4-3-5-7/h3-4,6H,1-2H3/b4-3-
InChI Key:
YZRARHFKUZRMCC-ARJAWSKDSA-N
SMILES:
N#C/C=C\C(C)C
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
95.073g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
95.145g/mol
Monoisotopic Mass:
95.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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