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Home Other Building Blocks 4-methoxy-2-[2-(thiophen-3-yl)ethoxy]benzoic acid

4-methoxy-2-[2-(thiophen-3-yl)ethoxy]benzoic acid

CAS No.:
1407126-29-7
Catalog Number:
AG01BE9R
Molecular Formula:
C14H14O4S
Molecular Weight:
278.3236
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Product Description
Catalog Number:
AG01BE9R
Chemical Name:
4-methoxy-2-[2-(thiophen-3-yl)ethoxy]benzoic acid
CAS Number:
1407126-29-7
Molecular Formula:
C14H14O4S
Molecular Weight:
278.3236
MDL Number:
MFCD19414427
IUPAC Name:
4-methoxy-2-(2-thiophen-3-ylethoxy)benzoic acid
InChI:
InChI=1S/C14H14O4S/c1-17-11-2-3-12(14(15)16)13(8-11)18-6-4-10-5-7-19-9-10/h2-3,5,7-9H,4,6H2,1H3,(H,15,16)
InChI Key:
CDRPHKJRXHUMQW-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OCCc1cscc1)C(=O)O
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.061g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.322g/mol
Monoisotopic Mass:
278.061g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties