Home Other Building Blocks 2-{2-[(pyridin-3-yl)methoxy]phenyl}acetic acid

2-{2-[(pyridin-3-yl)methoxy]phenyl}acetic acid

CAS No.:
1513346-23-0
Catalog Number:
AG01B6P8
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
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Product Description
Catalog Number:
AG01B6P8
Chemical Name:
2-{2-[(pyridin-3-yl)methoxy]phenyl}acetic acid
CAS Number:
1513346-23-0
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
MDL Number:
MFCD22997943
IUPAC Name:
2-[2-(pyridin-3-ylmethoxy)phenyl]acetic acid
InChI:
InChI=1S/C14H13NO3/c16-14(17)8-12-5-1-2-6-13(12)18-10-11-4-3-7-15-9-11/h1-7,9H,8,10H2,(H,16,17)
InChI Key:
WGYHSZZTNHKSPK-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccccc1OCc1cccnc1
Properties
Complexity:
270  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties