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Substance Name: Octyl alcohol, mixed isomers
RN: 29063-28-3
InChIKey: NMRPBPVERJPACX-UHFFFAOYSA-N
Molecular Formula
- C8-H18-O
Molecular Weight
- 130.229
- All
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- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Synonyms
- 4-01-00-01756 (Beilstein Handbook Reference)
- BRN 1697461
- EINECS 249-405-6
- Octanol, mixed isomers
Systematic Names
- Octanol
- Octyl alcohol, mixed isomers
Registry Numbers
CAS Registry Number
- 29063-28-3
System Generated Number
- 0029063283
Structure Descriptors
InChI
InChI=1S/C8H18O/c1-3-5-6-7-8(9)4-2/h8-9H,3-7H2,1-2H3InChIKey
NMRPBPVERJPACX-UHFFFAOYSA-NSmiles
CCCCCC(O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | 5660uL/kg (5.66mL/kg) | Union Carbide Data Sheet. Vol. 1/11/1968, | |
| rat | LD50 | oral | 5190uL/kg (5.19mL/kg) | Union Carbide Data Sheet. Vol. 1/11/1968, |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | -1.60E+01 | deg C | EXP | |
| Boiling Point | 195 | deg C | EXP | |
| log P (octanol-water) | 2.730 | (none) | EST | |
| Water Solubility | 586 | mg/L | 25 | EXP |
| Vapor Pressure | 0.217 | mm Hg | 25 | EST |
| Henry's Law Constant | 3.10E-05 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.73E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.