2,2-Dimethyl-1,3-dioxan-5-ol - CAS 3391-30-8
Catalog: |
BB067191 |
Product Name: |
2,2-Dimethyl-1,3-dioxan-5-ol |
CAS: |
3391-30-8 |
Synonyms: |
2,2-Dimethyl-m-dioxan-5-ol; 2,2-Dimethyl-[1,3]dioxan-5-ol; 5-Hydroxy-2,2-dimethyl-1,3-dioxane |
IUPAC Name: | 2,2-dimethyl-1,3-dioxan-5-ol |
Description: | 2,2-Dimethyl-1,3-dioxan-5-ol is a useful synthetic compound. |
Molecular Weight: | 132.16 |
Molecular Formula: | C6H12O3 |
Canonical SMILES: | CC1(OCC(CO1)O)C |
InChI: | InChI=1S/C6H12O3/c1-6(2)8-3-5(7)4-9-6/h5,7H,3-4H2,1-2H3 |
InChI Key: | CGNOMSJAJQUXAT-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 90.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 132.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 132.078644241 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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