Home Nitriles 2-(Butylamino)benzonitrile

2-(Butylamino)benzonitrile

CAS No.:
5589-61-7
Catalog Number:
AG00DKLE
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG00DKLE
Chemical Name:
2-(Butylamino)benzonitrile
CAS Number:
5589-61-7
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
MDL Number:
MFCD11144682
IUPAC Name:
2-(butylamino)benzonitrile
InChI:
InChI=1S/C11H14N2/c1-2-3-8-13-11-7-5-4-6-10(11)9-12/h4-7,13H,2-3,8H2,1H3
InChI Key:
VJOGMKBPRFJBQC-UHFFFAOYSA-N
SMILES:
CCCCNc1ccccc1C#N
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties