2,2-Dimethyl-1,3-pentanediol
2,2-dimethylpentane-1,3-diol
Also Known As: 2,2-Dimethyl-1,3-pentanediol|2,2-dimethylpentane-1,3-diol|1,3-Pentanediol, 2,2-dimethyl-|2,2,4-Trimethylbutandiol-1,3|2.2-Dimethylpentandiol-1.3|2,2,4-Trimethylbutane-1,3-diol|2,2,4-Trimethylbutandiol-1,3 [German]|0-01-00-00490 (Beilstein Handbook Reference)
CAS: 2157-31-5
| Molecular Formula | C7H16O2 |
|---|---|
| Molecular Weight | 132.11504 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 132.11504 |
| Monoisotopic Mass | 132.11504 |
| Heavy Atoms | 9 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 2157-31-5 |
|---|---|
| SMILES | CCC(C(C)(C)CO)O |
| InChIKey | QHDADHHODABHLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (1 patents)
Biotechnology (3 patents)
Catalysts (2 patents)
Coatings & Adhesives (18 patents)
Construction Chemicals (7 patents)
Food Additives (1 patents)
Heterocyclic Building Blocks (3 patents)
Organic Building Blocks (18 patents)
Organometallic Reagents (1 patents)
Peptides & Amino Acids (1 patents)
Pharmaceutical Intermediates (10 patents)
Photographic Chemicals (9 patents)
Plastic Additives (7 patents)
Polymer Intermediates (93 patents)
Specialty Chemicals (6 patents)
Surfactants & Detergents (44 patents)
Product Overview
2,2-Dimethyl-1,3-pentanediol (CAS 2157-31-5), with molecular formula C7H16O2 and molecular weight 132.11504 g/mol. IUPAC: 2,2-dimethylpentane-1,3-diol.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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