Hexylmalonic acid
2-hexylpropanedioic acid
Also Known As: Hexylmalonic acid|2-hexylmalonic acid|2-hexylpropanedioic acid|2-Hexyl-malonic acid|HexylMalonicAcid|2-Hexylmalonicacid|Malonic acid, hexyl-|Propanedioic acid, hexyl-|Hexylpropanedioic acid|a-Carboxycaprylic acid|1,1-Heptanedicarboxylic acid|.alpha.-Carboxycaprylic acid|Heptane-1,1-dicarboxylic acid|N-(3,5-DICHLORO-PHENYL)-FORMAMIDE
CAS: 3974-36-5
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10486 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.10486 |
| Monoisotopic Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 3974-36-5 |
|---|---|
| SMILES | CCCCCCC(C(=O)O)C(=O)O |
| InChIKey | UPFSMSDGKQSRLD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (13 patents)
Coatings & Adhesives (28 patents)
Construction Chemicals (3 patents)
Dyes & Pigments (2 patents)
Electronic Chemicals (7 patents)
Food Additives (1 patents)
Heterocyclic Building Blocks (12 patents)
Organic Building Blocks (47 patents)
Organometallic Reagents (7 patents)
Peptides & Amino Acids (4 patents)
Pharmaceutical Intermediates (24 patents)
Photographic Chemicals (17 patents)
Plastic Additives (30 patents)
Polymer Intermediates (164 patents)
Specialty Chemicals (21 patents)
Surfactants & Detergents (17 patents)
Product Overview
Hexylmalonic acid (CAS 3974-36-5), with molecular formula C9H16O4 and molecular weight 188.10486 g/mol. IUPAC: 2-hexylpropanedioic acid.
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.
View MSDS →
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