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123193-99-7 | Cycloheptanecarbonitrile, 1-amino-
CAS No: 123193-99-7 Catalog No: AG000K5J MDL No:MFCD09040679
Product Description
Catalog Number:
AG000K5J
Chemical Name:
Cycloheptanecarbonitrile, 1-amino-
CAS Number:
123193-99-7
Molecular Formula:
C8H14N2
Molecular Weight:
138.2102
MDL Number:
MFCD09040679
IUPAC Name:
1-aminocycloheptane-1-carbonitrile
InChI:
InChI=1S/C8H14N2/c9-7-8(10)5-3-1-2-4-6-8/h1-6,10H2
InChI Key:
DLMLXRYNXPKPII-UHFFFAOYSA-N
SMILES:
N#CC1(N)CCCCCC1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.116g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.214g/mol
Monoisotopic Mass:
138.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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