Home Nitriles [(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]carbonitrile

[(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]carbonitrile

CAS No.:
97482-07-0
Catalog Number:
AG019XGO
Molecular Formula:
C7H11N3
Molecular Weight:
137.1823
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Product Description
Catalog Number:
AG019XGO
Chemical Name:
[(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]carbonitrile
CAS Number:
97482-07-0
Molecular Formula:
C7H11N3
Molecular Weight:
137.1823
MDL Number:
MFCD01734106
IUPAC Name:
3,4,5,6-tetrahydro-2H-azepin-7-ylcyanamide
InChI:
InChI=1S/C7H11N3/c8-6-10-7-4-2-1-3-5-9-7/h1-5H2,(H,9,10)
InChI Key:
LBZZNASGPKRVDC-UHFFFAOYSA-N
SMILES:
N#CNC1=NCCCCC1
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
137.186g/mol
Monoisotopic Mass:
137.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties