Home Nitriles 4-N-Octylbenzonitrile

4-N-Octylbenzonitrile

CAS No.:
60484-68-6
Catalog Number:
AG00EAAO
Molecular Formula:
C15H21N
Molecular Weight:
215.3339
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$194
- +
1g
98%
In Stock USA
United States
$494
- +
5g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00EAAO
Chemical Name:
4-N-Octylbenzonitrile
CAS Number:
60484-68-6
Molecular Formula:
C15H21N
Molecular Weight:
215.3339
MDL Number:
MFCD00799351
IUPAC Name:
4-octylbenzonitrile
InChI:
InChI=1S/C15H21N/c1-2-3-4-5-6-7-8-14-9-11-15(13-16)12-10-14/h9-12H,2-8H2,1H3
InChI Key:
MWFMIIMHAJLWAY-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1ccc(cc1)C#N
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.167g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.34g/mol
Monoisotopic Mass:
215.167g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4  
Properties