1,4-Dioxaspiro[4.5]decan-2-one - CAS 4423-79-4
Catalog: |
BB025548 |
Product Name: |
1,4-Dioxaspiro[4.5]decan-2-one |
CAS: |
4423-79-4 |
Synonyms: |
1,4-dioxaspiro[4.5]decan-3-one |
IUPAC Name: | 1,4-dioxaspiro[4.5]decan-3-one |
Description: | 1,4-Dioxaspiro[4.5]decan-2-one (CAS# 4423-79-4) is a useful research chemical. |
Molecular Weight: | 156.18 |
Molecular Formula: | C8H12O3 |
Canonical SMILES: | C1CCC2(CC1)OCC(=O)O2 |
InChI: | InChI=1S/C8H12O3/c9-7-6-10-8(11-7)4-2-1-3-5-8/h1-6H2 |
InChI Key: | HBGAMCTZOLJGAS-UHFFFAOYSA-N |
Boiling Point: | 70 ℃ / 0.5 mmHg (lit.) |
Purity: | > 98.0 % (GC) |
Density: | 1.16 g/cm3 |
Appearance: | White solid |
MDL: | MFCD00010852 |
LogP: | 1.22020 |
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 |
WO-2021172511-A1 | Photochromic curable composition and photochromic optical article | 20200228 |
WO-2021172512-A1 | Photochromic optical article | 20200227 |
JP-6779444-B2 | Active energy ray-curable resin composition for model materials | 20190722 |
WO-2020032056-A1 | Curable composition containing polypseudorotaxane monomer | 20180808 |
WO-2020017610-A1 | Photochromic compound and curable composition containing said photochromic compound | 20180720 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.078644241 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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