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95898-93-4

95898-93-4 | 2-(2-Ethoxybenzoyl)pyridine

CAS No: 95898-93-4 Catalog No: AG01F074 MDL No:

Product Description

Catalog Number:
AG01F074
Chemical Name:
2-(2-Ethoxybenzoyl)pyridine
CAS Number:
95898-93-4
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
IUPAC Name:
(2-ethoxyphenyl)-pyridin-2-ylmethanone
InChI:
InChI=1S/C14H13NO2/c1-2-17-13-9-4-3-7-11(13)14(16)12-8-5-6-10-15-12/h3-10H,2H2,1H3
InChI Key:
JXBASIZJZPUFEM-UHFFFAOYSA-N
SMILES:
CCOc1ccccc1C(=O)c1ccccn1

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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