Tetrahydro-2H-pyran-4-carbonyl chloride - CAS 40191-32-0
Catalog: |
BB024358 |
Product Name: |
Tetrahydro-2H-pyran-4-carbonyl chloride |
CAS: |
40191-32-0 |
Synonyms: |
4-oxanecarbonyl chloride; oxane-4-carbonyl chloride |
IUPAC Name: | oxane-4-carbonyl chloride |
Description: | Tetrahydro-2H-pyran-4-carbonyl chloride (CAS# 40191-32-0) is a useful research chemical. |
Molecular Weight: | 148.59 |
Molecular Formula: | C6H9ClO2 |
Canonical SMILES: | C1COCCC1C(=O)Cl |
InChI: | InChI=1S/C6H9ClO2/c7-6(8)5-1-3-9-4-2-5/h5H,1-4H2 |
InChI Key: | RYGUCYSSMOFTSH-UHFFFAOYSA-N |
Boiling Point: | 50-52 °C (1 mmHg) |
Purity: | 94 % |
Density: | 1.201 g/cm3 |
MDL: | MFCD06200863 |
LogP: | 1.17840 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P273, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113214201-A | Napabucasin derivatives and pharmaceutical application thereof | 20210322 |
WO-2021211922-A1 | Spiro-sulfonimidamide derivatives as inhibitors of myeloid cell leukemia-1 (mcl-1) protein | 20200416 |
WO-2021210586-A1 | Condensed heterocyclic compound | 20200414 |
CN-111269215-A | Nitrogen-containing heterocyclic organic compound and preparation method and application thereof | 20200401 |
KR-20210052269-A | Novel Compound for Crop Protection | 20191029 |
Complexity: | 108 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.0291072 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.0291072 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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