4-(5-Formylthiophen-2-yl)phenol - CAS 893740-97-1
Catalog: |
BB064547 |
Product Name: |
4-(5-Formylthiophen-2-yl)phenol |
CAS: |
893740-97-1 |
Synonyms: |
4-(5-Formylthiophen-2-yl)phenol; 5-(4-Hydroxyphenyl)thiophene-2-carbaldehyde; 5-(4-Hydroxyphenyl)-2-thiophenecarbaldehyde |
IUPAC Name: | 5-(4-hydroxyphenyl)thiophene-2-carbaldehyde |
Description: | 4-(5-Formylthiophen-2-yl)phenol |
Molecular Weight: | 204.25 |
Molecular Formula: | C11H8O2S |
Canonical SMILES: | C1=CC(=CC=C1C2=CC=C(S2)C=O)O |
InChI: | InChI=1S/C11H8O2S/c12-7-10-5-6-11(14-10)8-1-3-9(13)4-2-8/h1-7,13H |
InChI Key: | CTJUQMCNJMQHLD-UHFFFAOYSA-N |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.02450067 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.02450067 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 65.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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