Tetrahydro-5-methyl-2-furanmethanol, mixture of diastereomers - CAS 6126-49-4
Catalog: |
BB057568 |
Product Name: |
Tetrahydro-5-methyl-2-furanmethanol, mixture of diastereomers |
CAS: |
6126-49-4 |
Synonyms: |
Tetrahydro-5-methyl-2-furanmethanol; (5-Methyltetrahydrofuran-2-yl)methanol; 5-Methyltetrahydrofurfuryl Alcohol |
IUPAC Name: | (5-methyloxolan-2-yl)methanol |
Description: | Tetrahydro-5-methyl-2-furanmethanol, is shown to be one of the volatile components in grapes, milk, and etc. |
Molecular Weight: | 116.16 |
Molecular Formula: | C6H12O2 |
Canonical SMILES: | CC1CCC(O1)CO |
InChI: | InChI=1S/C6H12O2/c1-5-2-3-6(4-7)8-5/h5-7H,2-4H2,1H3 |
InChI Key: | PCZHHBOJPSQUNS-UHFFFAOYSA-N |
Melting Point: | No data available |
Solubility: | Chloroform (Slightly), Ethyl Acetate (Slightly) |
Appearance: | Clear Colorless Oil |
Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
References: | Mentasti, T., et al. Milchwissenchaft, 52, 253 (1997). |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P303+P361+P353, P305+P351+P338, P330, P337+P317, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3347126-A1 | Transition metal(s) catalyst supported on nitrogen-doped mesoporous carbon and its use in catalytic transfer hydrogenation reactions | 20150910 |
WO-2017042838-A1 | Transition metal(s) catalyst supported on nitrogen-doped mesoporous carbon and its use in catalytic transfer hydrogenation reactions | 20150910 |
US-2020230578-A1 | Transition metal(s) catalyst supported on nitrogen-doped mesoporous carbon and its use in catalytic transfer hydrogenation reactions | 20150910 |
US-11000831-B2 | Transition metal(s) catalyst supported on nitrogen-doped mesoporous carbon and its use in catalytic transfer hydrogenation reactions | 20150910 |
US-2017233361-A1 | Process for the manufacture of furural and furfural derivatives | 20140814 |
WO-2016025677-A1 | Process for the manufacture of furural and furfural derivatives | 20140814 |
EP-3142997-A1 | Methods of producing compounds from 5-(halomethyl)furfural | 20140512 |
US-10407547-B2 | Methods of producing compounds from 5-(halomethyl)furfural | 20140512 |
US-2017081470-A1 | Methods of producing compounds from 5-(halomethyl)furfural | 20140512 |
WO-2015175528-A1 | Methods of producing compounds from 5-(halomethyl)furfural | 20140512 |
Complexity: | 72.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 116.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 116.083729621 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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