40199
Methyl tetrahydro-2H-pyran-4-carboxylate
produced by BASF, ≥98.0% (GC)
Synonym(s):
THPE
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About This Item
Empirical Formula (Hill Notation):
C7H12O3
CAS Number:
Molecular Weight:
144.17
Beilstein:
114974
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
grade
produced by BASF
Quality Level
Assay
≥98.0% (GC)
form
liquid
density
1.080 g/mL at 20 °C (lit.)
SMILES string
COC(=O)C1CCOCC1
InChI
1S/C7H12O3/c1-9-7(8)6-2-4-10-5-3-6/h6H,2-5H2,1H3
InChI key
CNCMVGXVKBJYNU-UHFFFAOYSA-N
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Related Categories
Application
Methyl tetrahydro-2H-pyran-4-carboxylate may be used in the following syntheses:
- cycloalkylamide derivatives
- tetrahydro-2-furoic chloride
- tetrahydro-2H-pyran-4-carboxylic chloride
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2
WGK
WGK 2
Flash Point(F)
closed cup
Flash Point(C)
closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Certificates of Analysis (COA)
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In-Hae Kim et al.
Journal of medicinal chemistry, 54(6), 1752-1761 (2011-02-23)
Structure-activity relationships of cycloalkylamide compounds as inhibitors of human sEH were investigated. When the left side of amide function was modified by a variety of cycloalkanes, at least a C6 like cyclohexane was necessary to yield reasonable inhibition potency on
Han Xiao et al.
Environmental pollution (Barking, Essex : 1987), 260, 113962-113962 (2020-02-01)
Tris (4-hydroxyphenyl)ethane (THPE), a trisphenol compound widely used as a branching agent and raw material in plastics, adhesives, and coatings is rarely regarded with concern. However, inspection of in vitro data suggests that THPE is an antagonist of estrogen receptors (ERs).
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