5-[(2-Methoxyphenoxy)methyl]thiophene-2-carboxylic acid - CAS 934080-88-3
Catalog: |
BB049222 |
Product Name: |
5-[(2-Methoxyphenoxy)methyl]thiophene-2-carboxylic acid |
CAS: |
934080-88-3 |
Synonyms: |
5-(2-methoxyphenoxymethyl)thiophene-2-carboxylic acid |
IUPAC Name: | 5-[(2-methoxyphenoxy)methyl]thiophene-2-carboxylic acid |
Description: | 5-[(2-Methoxyphenoxy)methyl]thiophene-2-carboxylic acid (CAS# 934080-88-3 ) is a useful research chemical. |
Molecular Weight: | 264.3 |
Molecular Formula: | C13H12O4S |
Canonical SMILES: | COC1=CC=CC=C1OCC2=CC=C(S2)C(=O)O |
InChI: | InChI=1S/C13H12O4S/c1-16-10-4-2-3-5-11(10)17-8-9-6-7-12(18-9)13(14)15/h2-7H,8H2,1H3,(H,14,15) |
InChI Key: | SFZNBJPBZIMGQE-UHFFFAOYSA-N |
Boiling Point: | 434.5±40.0 ℃ (Predicted) |
Density: | 1.320±0.06 g/cm3(Predicted) |
Complexity: | 284 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.04563003 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 264.04563003 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 84 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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