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Substance Name: 1-Undecanol
RN: 112-42-5
UNII: 06MJ0P28T3
InChIKey: KJIOQYGWTQBHNH-UHFFFAOYSA-N
Classification Codes
- Agricultural Chemical
- Growth Regulator / Fertilizer
- Mutation Data
- Skin / Eye Irritant
Molecular Formula
- C11-H24-O
Molecular Weight
- 172.3096
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 1-Undecanol
- Alcohol, undecyl
- Undecyl alcohol
Synonyms
- 1-Hendecanol
- 1-Undecanol
- 1-Undecyl alcohol
- 4-01-00-01835 (Beilstein Handbook Reference)
- AI3-00330
- Alcohol C-11
- BRN 1698334
- C11 alcohol
- Decyl carbinol
- EC 203-970-5
- EINECS 203-970-5
- Fatty alcohol(C11)
- FEMA No. 3097
- Hendecanoic alcohol
- Hendecyl alcohol
- HSDB 1089
- n-Hendecylenic alcohol
- n-Undecan-1-ol
- n-Undecanol
- n-Undecyl alcohol
- NSC 403667
- Tip-Nip
- Undecanol
- Undecyl alcohol
- UNII-06MJ0P28T3
Systematic Names
- 1-Undecanol
- Undecan-1-ol
- Undecyl alcohol
Superlist Names
- 1-Undecyl alcohol
- Undecanol
- Undecyl alcohol
Registry Numbers
CAS Registry Number
- 112-42-5
FDA UNII
- 06MJ0P28T3
System Generated Number
- 0000112425
Structure Descriptors
InChI
InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3InChIKey
KJIOQYGWTQBHNH-UHFFFAOYSA-NSmiles
CCCCCCCCCCCOToxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LD50 | skin | > 20mL/kg (20mL/kg) | "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 695, 1969. | |
| rabbit | LD50 | skin | 4760uL/kg (4.76mL/kg) | Union Carbide Data Sheet. Vol. 2/21/1958, | |
| rat | LD50 | oral | 3gm/kg (3000mg/kg) | Journal of Industrial Hygiene and Toxicology. Vol. 26, Pg. 269, 1944. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 19 | deg C | EXP | |
| Boiling Point | 243 | deg C | EXP | |
| log P (octanol-water) | 4.280 | (none) | EST | |
| Water Solubility | 19.1 | mg/L | 25 | EST |
| Vapor Pressure | 0.00297 | mm Hg | 25 | EXP |
| Henry's Law Constant | 7.26E-05 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.68E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.