Home Carboxys 3-(benzyloxy)-5-phenylthiophene-2-carboxylic acid

3-(benzyloxy)-5-phenylthiophene-2-carboxylic acid

CAS No.:
113589-51-8
Catalog Number:
AG019V40
Molecular Formula:
C18H14O3S
Molecular Weight:
310.3670
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Product Description
Catalog Number:
AG019V40
Chemical Name:
3-(benzyloxy)-5-phenylthiophene-2-carboxylic acid
CAS Number:
113589-51-8
Molecular Formula:
C18H14O3S
Molecular Weight:
310.3670
MDL Number:
MFCD11858119
IUPAC Name:
5-phenyl-3-phenylmethoxythiophene-2-carboxylic acid
InChI:
InChI=1S/C18H14O3S/c19-18(20)17-15(21-12-13-7-3-1-4-8-13)11-16(22-17)14-9-5-2-6-10-14/h1-11H,12H2,(H,19,20)
InChI Key:
XAWMCAWSRFMDJA-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc(cc1OCc1ccccc1)c1ccccc1
Properties
Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.066g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
310.367g/mol
Monoisotopic Mass:
310.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties