1,4-Cyclohexanedione mono(2,2-dimethyltrimethylene ketal) - CAS 69225-59-8
Catalog: |
BB033740 |
Product Name: |
1,4-Cyclohexanedione mono(2,2-dimethyltrimethylene ketal) |
CAS: |
69225-59-8 |
Synonyms: |
3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-9-one |
IUPAC Name: | 3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-9-one |
Description: | Reagent used in the preparation of carbazole derivatives. |
Molecular Weight: | 198.26 |
Molecular Formula: | C11H18O3 |
Canonical SMILES: | CC1(COC2(CCC(=O)CC2)OC1)C |
InChI: | InChI=1S/C11H18O3/c1-10(2)7-13-11(14-8-10)5-3-9(12)4-6-11/h3-8H2,1-2H3 |
InChI Key: | COKVDTKAWIFNTH-UHFFFAOYSA-N |
Boiling Point: | 295.4 ℃ at 760 mmHg |
Density: | 1.08 g/cm3 |
Appearance: | White to off-white powder |
MDL: | MFCD00006652 |
LogP: | 1.89880 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111234580-A | Special anticorrosive paint for ceramics and preparation method thereof | 20200323 |
CN-111234580-B | Special anticorrosive paint for ceramics and preparation method thereof | 20200323 |
JP-2017014442-A | Pressure-sensitive adhesive, pressure-sensitive adhesive film, and optical laminate using the same | 20150706 |
JP-2015163603-A | A medicament containing a partially saturated nitrogen-containing heterocyclic compound as an active ingredient | 20140129 |
JP-6173364-B2 | A medicament containing a partially saturated nitrogen-containing heterocyclic compound as an active ingredient | 20140129 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.125594432 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.125594432 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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