| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 3913-02-8 |
| ECHA EC Number: | 223-470-0 |
| FDA UNII: | N442D9VO79 |
| Category: | solvents |
| IUPAC Name: | butyl octanol |
| InChI : | InChI=1/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3 |
| Std.InChI: | InChI=1S/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3 |
| InChIKey : | XMVBHZBLHNOQON-UHFFFAOYAJ |
| Std.InChIKey: | XMVBHZBLHNOQON-UHFFFAOYSA-N |
| SMILES : | CCCCCCC(CCCC)CO |
| MDL: | MFCD00053508 |
| Molar Refractivity : | 59.13 ± 0.3 cm3 (est) |
| Parachor : | 523.6 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.439 ± 0.02 (est) |
| Surface Tension : | 29.6 ± 3.0 dyne/cm (est) |
| Density : | 0.829 ± 0.06 g/cm3 (est) |
| Polarizability : | 23.44 ± 0.5 10-24cm3 (est) |
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 145.00 to 149.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 245.00 to 246.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.005000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 212.00 °F. TCC ( 100.10 °C. ) (est) |
| logP (o/w): | 4.759 (est) |
| Soluble in: | |
| alcohol | |
| water, 16.18 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| CosIng: | cosmetic data |
| Cosmetic Uses: | humectants solvents |
| BOC Sciences |
| For experimental / research use only. |
| 2-Butyl-1-octanol 95% |
| Jarchem Industries |
| Jarcol™ I-12 Odor: characteristic Use: Is an excellent base alcohol for esterification, ethoxylation, propoxylation, and other reaction chemistries. It\'s extremely low melt point (-30 degrees c) makes it much easier to work with than traditional C12-C14 alcohols and results in down stream products with unique functional characteristics. JARCOL I-12 is synthetically derived providing essentially pure material with reduced side reaction impurities. |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 2-Butyl-1-octanol 95% |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 2-Butyl-1-octanol 95% |
| TCI AMERICA |
| For experimental / research use only. |
| 2-Butyl-1-n-octanol >98.0%(GC) |
| Preferred SDS: View | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 13000 mg/kg AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| solvents | |||
| Recommendation for butyl octanol usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for butyl octanol flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):3913-02-8 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :19800 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 2-butyloctan-1-ol |
| Chemidplus:0003913028 |
| RTECS:RH0885000 for cas# 3913-02-8 |
| 2-butyloctan-1-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 19800 |
| Pubchem (sid): | 134984904 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB41288 |
| FooDB: | FDB021205 |
| Export Tariff Code: | 2905.19.9090 |
| ChemSpider: | View |
| None Found |
| humectants |
| not found in nature |
| 2- | butyl octyl alcohol |
| 2- | butyl-1-octanol |
| 2- | butyloctan-1-ol |
| butyloctanol | |
| 2- | butyloctanol |
| 2- | butyloctyl alcohol |
| 5-( | hydroxymethyl)undecane |
| 1- | octanol, 2-butyl- |
| None found yet. Try the PubMed Search. |
