Basic information
- CAS
5660-53-7- Standard SMILES
CC(C)CC1(C)OCC(CO)O1- InChIKey
DFDWGIZZMBNYBV-UHFFFAOYSA-N- Molecular formula
- C9H18O3
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.12559443
Names & identifiers
- Preferred name
- 2-Isobutyl-2-methyl-1,3-dioxolane-4-methanol
- IUPAC
- [2-methyl-2-(2-methylpropyl)-1,3-dioxolan-4-yl]methanol
- English name
- 4-Hydroxymethyl-2-isobutyl-2-methyl-1,3-dioxolane
- Molecular formula
- C9H18O3
- Molecular weight
- 174.24
Names & synonyms
5660-53-72-Isobutyl-2-methyl-1,3-dioxolane-4-methanol1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)-NSC 70004BRN 0106485667AGW60OZAI3-175481,3-DIOXOLANE-4-METHANOL, 2-ISOBUTYL-2-METHYL-NSC-700042-Pentanone, 4-methyl-, cyclic (hydroxymethyl)ethylene acetalDTXSID00884180EC 692-614-6
Show more names
MIBK glycerin(2-isobutyl-2-methyl-1,3-dioxolan-4-yl)methanol
4-19-00-00678 (Beilstein Handbook Reference)(2-METHYL-2-ISOBUTYL-1,3-DIOXOLAN-4-YL)METHANOLRefChem:473805DTXCID3010236402-ISOBUTYL-2-METHYL-1,3-DIOXOLANE-4-METHANOL (COMPONENT OF METHYL ISOBUTYL GLYCEROL FORMAL)692-614-6[2-methyl-2-(2-methylpropyl)-1,3-dioxolan-4-yl]methanol4-Hydroxymethyl-2-isobutyl-2-methyl-1,3-dioxolane
Database identifiers
- CAS
5660-53-7- PubChem CID
- 21869
- DTXSID
DTXSID00884180- UNII
- 667AGW60OZ
- EC Number
- 692-614-6
- Nikkaji
- J25.438J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Experimental & physicochemical properties
Physical DescriptionLiquid
Physicochemical properties
- Boiling point
- 230 · 230-231℃ at 101kPa
- Density
- 1 · 1-1.001g/cm3 at 20℃
- vapor pressure
- 28 · 28-42Pa at 20-25℃
- Cosmetics Ingredients Functions
- SOLVENT
- LogP
- 1.57 · 1.57
- FDA UNII
- 667 AGW60OZ · 667AGW60OZ
- EPA Substance Registry System
- 1 · 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)- (5660-53-7)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Chemical: 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)-
1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 2-isobutyl-2-methyl-1,3-dioxolane-4-methanol (EC: 692-614-6)
Other Safety InformationNC Assessments - 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)-: Health and Environment
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H318
- REACH Registrations
- Inactive
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Uses & manufacturing
U.S. Production2023: <75,000 lb
Industry UsesSolvent
Household ProductsInformation on 3 consumer products that contain 2-Isobutyl-2-methyl-1,3-dioxolane-4-methanol in the following categories is provided:
General Manufacturing Information
Soap, Cleaning Compound, and Toilet Preparation Manufacturing
1,3-Dioxolane-4-methanol, 2-methyl-2-(2-methylpropyl)-: ACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers3 total
湖南秉航新材料有限公司85521272 18932438858 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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