Methyl tetrahydro-2H-pyran-4-carboxylate - CAS 110238-91-0
Catalog: |
BB002607 |
Product Name: |
Methyl tetrahydro-2H-pyran-4-carboxylate |
CAS: |
110238-91-0 |
Synonyms: |
methyl oxane-4-carboxylate |
IUPAC Name: | methyl oxane-4-carboxylate |
Description: | Methyl tetrahydro-2H-pyran-4-carboxylate (CAS# 110238-91-0) is a useful research chemical. |
Molecular Weight: | 144.17 |
Molecular Formula: | C7H12O3 |
Canonical SMILES: | COC(=O)C1CCOCC1 |
InChI: | InChI=1S/C7H12O3/c1-9-7(8)6-2-4-10-5-3-6/h6H,2-5H2,1H3 |
InChI Key: | CNCMVGXVKBJYNU-UHFFFAOYSA-N |
Boiling Point: | 197 °C |
Density: | 1.08 g/cm3 |
MDL: | MFCD01075170 |
LogP: | 0.58600 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P273, P280, P305+P351+P338, P310, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113501828-A | 2, 8-dioxaspiro [4.5] decane-1-one and preparation method and application thereof | 20210707 |
WO-2021197339-A1 | Crystal form of quinopyrrolidine-2-one compound serving as atm inhibitor and use thereof | 20200330 |
CN-112778311-A | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 20191101 |
WO-2021064189-A2 | Prostaglandin e2 (pge2) ep4 receptor antagonists | 20191002 |
WO-2021053402-A2 | Compounds | 20190920 |
Complexity: | 116 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.078644241 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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