sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 1-Phenyl-2-(pyridin-4-yl)ethanone

1-Phenyl-2-(pyridin-4-yl)ethanone

CAS No.:
1620-55-9
Catalog Number:
AG001SM5
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$132
- +
5g
98%
In Stock USA
United States
$388
- +
10g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG001SM5
Chemical Name:
1-Phenyl-2-(pyridin-4-yl)ethanone
CAS Number:
1620-55-9
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
MDL Number:
MFCD00234969
IUPAC Name:
1-phenyl-2-pyridin-4-ylethanone
InChI:
InChI=1S/C13H11NO/c15-13(12-4-2-1-3-5-12)10-11-6-8-14-9-7-11/h1-9H,10H2
InChI Key:
ACULMSXMKICJIS-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Cc1ccncc1
NSC Number:
146504
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Tuning the redox chemistry of 4-benzoyl-N-methylpyridinium cations through para substitution. Hammett linear free energy relationships and the relative aptitude of the two-electron reduced forms for H-bonding. The Journal of organic chemistry 20021018
Properties