Home Nitriles 3-phenyl-1,3,5-pentanetricarbonitrile

3-phenyl-1,3,5-pentanetricarbonitrile

CAS No.:
16320-20-0
Catalog Number:
AG00BBI8
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$406
- +
5g
1 week
United States
$1692
- +
10g
1 week
United States
$2849
- +
25g
1 week
United States
$6010
- +
Product Description
Catalog Number:
AG00BBI8
Chemical Name:
3-phenyl-1,3,5-pentanetricarbonitrile
CAS Number:
16320-20-0
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
MDL Number:
MFCD00085590
IUPAC Name:
3-phenylpentane-1,3,5-tricarbonitrile
InChI:
InChI=1S/C14H13N3/c15-10-4-8-14(12-17,9-5-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9H2
InChI Key:
KVDYEBISIZWSRT-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccc1)(CCC#N)CCC#N
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.111g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.279g/mol
Monoisotopic Mass:
223.111g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties