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1187165-41-8

1187165-41-8 | 3-(2,3-Dimethoxybenzoyl)pyridine

CAS No: 1187165-41-8 Catalog No: AG01FEKC MDL No:

Product Description

Catalog Number:
AG01FEKC
Chemical Name:
3-(2,3-Dimethoxybenzoyl)pyridine
CAS Number:
1187165-41-8
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
IUPAC Name:
(2,3-dimethoxyphenyl)-pyridin-3-ylmethanone
InChI:
InChI=1S/C14H13NO3/c1-17-12-7-3-6-11(14(12)18-2)13(16)10-5-4-8-15-9-10/h3-9H,1-2H3
InChI Key:
YPCWMPZCJAATLH-UHFFFAOYSA-N
SMILES:
COc1c(OC)cccc1C(=O)c1cccnc1

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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