Home Nitriles 1-(Methylamino)cyclohexanecarbonitrile

1-(Methylamino)cyclohexanecarbonitrile

CAS No.:
6289-40-3
Catalog Number:
AG00EKQT
Molecular Formula:
C8H14N2
Molecular Weight:
138.2102
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$744
- +
Product Description
Catalog Number:
AG00EKQT
Chemical Name:
1-(Methylamino)cyclohexanecarbonitrile
CAS Number:
6289-40-3
Molecular Formula:
C8H14N2
Molecular Weight:
138.2102
MDL Number:
MFCD00972028
IUPAC Name:
1-(methylamino)cyclohexane-1-carbonitrile
InChI:
InChI=1S/C8H14N2/c1-10-8(7-9)5-3-2-4-6-8/h10H,2-6H2,1H3
InChI Key:
DSMAHJDZYJDGTD-UHFFFAOYSA-N
SMILES:
CNC1(CCCCC1)C#N
NSC Number:
5660
Properties
Complexity:
148  
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:
1  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties