200,000+ products from a single source!
sales@angenechem.com
7451-95-8 | Benzeneacetaldehyde,2-hydroxy-
CAS No: 7451-95-8 Catalog No: AG005AT5 MDL No:
Product Description
Catalog Number:
AG005AT5
Chemical Name:
Benzeneacetaldehyde,2-hydroxy-
CAS Number:
7451-95-8
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
IUPAC Name:
2-(2-hydroxyphenyl)acetaldehyde
InChI:
InChI=1S/C8H8O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,6,10H,5H2
InChI Key:
RFBOLEJBSGUBPZ-UHFFFAOYSA-N
SMILES:
O=CCc1ccccc1O
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.15g/mol
Monoisotopic Mass:
136.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| 1-(5,7-Dihy-droxy-2,2-dimethylchroman-6-yl)ethanone. | Acta crystallographica. Section E, Structure reports online 20111201 |
| A novel 9-MC-3 and 15-MC-6 onset stacked metallacrown single-molecule magnet: synthesis and crystal structure. | Inorganic chemistry 20110404 |
| Ferromagnetic manganese 'cubes': from PSII to single-molecule magnets. | Dalton transactions (Cambridge, England : 2003) 20100528 |
| In silico methods for physiologically based biokinetic models describing bioactivation and detoxification of coumarin and estragole: implications for risk assessment. | Molecular nutrition & food research 20100201 |
| Constructing clusters with enhanced magnetic properties by assembling and distorting Mn3 building blocks. | Dalton transactions (Cambridge, England : 2003) 20090421 |
| Differences in simulated liver concentrations of toxic coumarin metabolites in rats and different human populations evaluated through physiologically based biokinetic (PBBK) modeling. | Toxicology in vitro : an international journal published in association with BIBRA 20081201 |
| A [MnIII3O]7+ single-molecule magnet: the anisotropy barrier enhanced by structural distortion. | Inorganic chemistry 20081117 |
| [Isolation and characterization of a benzothiophene-desulfurizing bacterium]. | Huan jing ke xue= Huanjing kexue 20060601 |
| Solid-phase oligosaccharide synthesis of a small library of N-glycans. | Chemistry (Weinheim an der Bergstrasse, Germany) 20060123 |
| Roles for epoxidation and detoxification of coumarin in determining species differences in clara cell toxicity. | Toxicological sciences : an official journal of the Society of Toxicology 20041101 |
| Metabolic detoxification determines species differences in coumarin-induced hepatotoxicity. | Toxicological sciences : an official journal of the Society of Toxicology 20040801 |
| Liquid chromatographic determination of the glutathione conjugate and ring-opened metabolites formed from coumarin epoxidation. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20030905 |
| Comparative metabolism and kinetics of coumarin in mice and rats. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20030201 |
| CYP2A13-catalysed coumarin metabolism: comparison with CYP2A5 and CYP2A6. | Xenobiotica; the fate of foreign compounds in biological systems 20030101 |
| Coumarin metabolism by rat esophageal microsomes and cytochrome P450 2A3. | Chemical research in toxicology 20011001 |
| Benzo[b]thiophene desulfurization by Gordonia rubropertinctus strain T08. | Applied microbiology and biotechnology 20011001 |
| Isolation of a unique benzothiophene-desulphurizing bacterium, Gordona sp. strain 213E (NCIMB 40816), and characterization of the desulphurization pathway. | Microbiology (Reading, England) 19980901 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.