Home Carboxys 4-(benzyloxy)thiophene-2-carboxylic acid

4-(benzyloxy)thiophene-2-carboxylic acid

CAS No.:
1510918-76-9
Catalog Number:
AG01BVIH
Molecular Formula:
C12H10O3S
Molecular Weight:
234.2710
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Product Description
Catalog Number:
AG01BVIH
Chemical Name:
4-(benzyloxy)thiophene-2-carboxylic acid
CAS Number:
1510918-76-9
Molecular Formula:
C12H10O3S
Molecular Weight:
234.2710
MDL Number:
MFCD21774997
IUPAC Name:
4-phenylmethoxythiophene-2-carboxylic acid
InChI:
InChI=1S/C12H10O3S/c13-12(14)11-6-10(8-16-11)15-7-9-4-2-1-3-5-9/h1-6,8H,7H2,(H,13,14)
InChI Key:
QWDOZQBTWSVZGX-UHFFFAOYSA-N
SMILES:
OC(=O)c1scc(c1)OCc1ccccc1
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.035g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.269g/mol
Monoisotopic Mass:
234.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties