Home Halogens 4-chloro-2-[2-(pyridin-3-yl)ethoxy]benzoic acid

4-chloro-2-[2-(pyridin-3-yl)ethoxy]benzoic acid

CAS No.:
1275950-89-4
Catalog Number:
AG01ACQG
Molecular Formula:
C14H12ClNO3
Molecular Weight:
277.7030
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Product Description
Catalog Number:
AG01ACQG
Chemical Name:
4-chloro-2-[2-(pyridin-3-yl)ethoxy]benzoic acid
CAS Number:
1275950-89-4
Molecular Formula:
C14H12ClNO3
Molecular Weight:
277.7030
MDL Number:
MFCD19125671
IUPAC Name:
4-chloro-2-(2-pyridin-3-ylethoxy)benzoic acid
InChI:
InChI=1S/C14H12ClNO3/c15-11-3-4-12(14(17)18)13(8-11)19-7-5-10-2-1-6-16-9-10/h1-4,6,8-9H,5,7H2,(H,17,18)
InChI Key:
SEFDGGWYVIELBH-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)OCCc1cccnc1)C(=O)O
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.051g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.704g/mol
Monoisotopic Mass:
277.051g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties