3-Ethoxybenzyl alcohol - CAS 71648-21-0
Catalog: |
BB034442 |
Product Name: |
3-Ethoxybenzyl alcohol |
CAS: |
71648-21-0 |
Synonyms: |
(3-ethoxyphenyl)methanol |
IUPAC Name: | (3-ethoxyphenyl)methanol |
Description: | 3-Ethoxybenzyl alcohol (CAS# 71648-21-0) is a useful research chemical. |
Molecular Weight: | 152.19 |
Molecular Formula: | C9H12O2 |
Canonical SMILES: | CCOC1=CC=CC(=C1)CO |
InChI: | InChI=1S/C9H12O2/c1-2-11-9-5-3-4-8(6-9)7-10/h3-6,10H,2,7H2,1H3 |
InChI Key: | PDYCXUZHSKLETQ-UHFFFAOYSA-N |
Boiling Point: | 263 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.08 g/mL at 25 ℃ (lit.) |
Appearance: | Colorless liquid |
LogP: | 1.57760 |
Publication Number | Title | Priority Date |
CN-111645159-A | Anti-mildew treatment method for surface of toothbrush handle and toothbrush | 20200618 |
CN-111645159-B | Anti-mildew treatment method for surface of toothbrush handle and toothbrush | 20200618 |
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PMID | Publication Date | Title | Journal |
16724218 | 20061001 | Identification of sulfation sites of metabolites and prediction of the compounds' biological effects | Analytical and bioanalytical chemistry |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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