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About This Item
Linear Formula:
C10H7CH(CH3)OH
CAS Number:
Molecular Weight:
172.22
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
98%
form
solid
mp
73-78 °C (lit.)
SMILES string
CC(O)c1ccc2ccccc2c1
InChI
1S/C12H12O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-9,13H,1H3
InChI key
AXRKCRWZRKETCK-UHFFFAOYSA-N
General description
α-Methyl-2-naphthalenemethanol forms complexes and multimers with methyl lactate. α-Methyl-2-naphthalenemethanol on reaction with sulfur trioxide-dimethylformamide complex and pyridine yields sulfated products.
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Identification of sulfation sites of metabolites and prediction of the compounds' biological effects.
Yi L, et al.
Analytical and Bioanalytical Chemistry, 383(6), 666-674 (2006)
Zhiye Tang et al.
Journal of chemical theory and computation, 13(5), 2230-2244 (2017-04-19)
We introduce a novel method, Pathway Search guided by Internal Motions (PSIM), that efficiently finds molecular dissociation pathways of a ligand-receptor system with guidance from principal component (PC) modes obtained from molecular dynamics (MD) simulations. Modeling ligand-receptor dissociation pathways can
K Le Barbu-Debus et al.
Physical chemistry chemical physics : PCCP, 11(35), 7589-7598 (2009-12-03)
Complexation between (1R,2S)-(+)-cis-1-amino-2-indanol (AI) and the two enantiomers of methyl lactate has been studied by means of laser-induced fluorescence, resonance-enhanced two-photon ionisation, and IR-UV double resonance spectroscopy, in the region of 3 microm. Two isomeric complexes have been spectroscopically characterised
Akiyuki Ryoki et al.
Journal of chromatography. A, 1599, 144-151 (2019-04-21)
Coated-type chiral stationary phases (CSPs) for high-performance liquid chromatography (HPLC) were prepared from three cyclic amylose tris(3,5-dimethylphenylcarbamate) (cADMPC) samples, of which weight-average molar mass (Mw) ranges from 19 to 91 kg mol-1, and from three linear ADMPC samples ranging in Mw
Danlei Wang et al.
Chemico-biological interactions, 315, 108905-108905 (2019-11-26)
Mineral oils are widely applied in food production and processing and may contain polycyclic aromatic hydrocarbons (PAHs). The PAHs that may be present in mineral oils are typically alkylated, and have been barely studied. Metabolic oxidation of the aromatic ring
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