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15595-71-8 | 1-Cyclohexene-1-carbonitrile, 2-amino-
CAS No: 15595-71-8 Catalog No: AG001OE0 MDL No:MFCD16046430
Product Description
Catalog Number:
AG001OE0
Chemical Name:
1-Cyclohexene-1-carbonitrile, 2-amino-
CAS Number:
15595-71-8
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
MDL Number:
MFCD16046430
IUPAC Name:
2-aminocyclohexene-1-carbonitrile
InChI:
InChI=1S/C7H10N2/c8-5-6-3-1-2-4-7(6)9/h1-4,9H2
InChI Key:
PFIVIEDNXASHEY-UHFFFAOYSA-N
SMILES:
N#CC1=C(N)CCCC1
NSC Number:
153146
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
122.171g/mol
Monoisotopic Mass:
122.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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