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Substance Name: sec-Butyl acetate
RN: 105-46-4
UNII: UVH2QII6CG
InChIKey: DCKVNWZUADLDEH-UHFFFAOYSA-N
Classification Codes
- Reportable Quantity (RQ) = 5000 lb
- TWA (200 ppm)
- TWA 200 ppm (950 mg/m3)
Molecular Formula
- C6-H12-O2
Molecular Weight
- 116.159
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- sec-Butyl acetate
Synonyms
- 1-Methylpropyl acetate
- 1-Methylpropyl ethanoate
- 2-Butanol acetate
- 2-Butyl acetate
- 4-02-00-00148 (Beilstein Handbook Reference)
- Acetate de butyle secondaire
- Acetate de butyle secondaire [French]
- Acetic acid secondary butyl ester
- Acetic acid, 1-methylpropyl ester
- Acetic acid, 2-butoxy ester
- Acetic acid, sec-butyl ester
- BRN 1720689
- EINECS 203-300-1
- HSDB 673
- NSC 8034
- sec-Butyl acetate
- sec-Butyl alcohol acetate
- sec-Butyl ethanoate
- UNII-UVH2QII6CG
Systematic Names
- Acetic acid, 1-methylpropyl ester
- Acetic acid, sec-butyl ester
- sec-Butyl acetate
Superlist Names
- Acetic acid, 1-methylpropyl ester
- Butyl acetates
- Butyl acetates [UN1123] [Flammable liquid]
- sec-Butyl acetate
- UN1123
Registry Numbers
CAS Registry Number
- 105-46-4
FDA UNII
- UVH2QII6CG
Other Registry Number
- 116698-48-7
System Generated Number
- 0000105464
Structure Descriptors
InChI
1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3InChIKey
DCKVNWZUADLDEH-UHFFFAOYSA-NSmiles
O([C@@H](CC)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LCLo | inhalation | 24000ppm/4H (24000ppm) | National Technical Information Service. Vol. OTS0556683, | |
rat | LD50 | oral | 3200mg/kg (3200mg/kg) | National Technical Information Service. Vol. OTS0556683, |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | -9.89E+01 | deg C | EXP | |
Boiling Point | 112 | deg C | EXP | |
log P (octanol-water) | 1.72 | (none) | EXP | |
Water Solubility | 6200 | mg/L | 20 | EXP |
Vapor Pressure | 17 | mm Hg | 20 | EXP |
Henry's Law Constant | 4.19E-04 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 5.50E-12 | cm3/molecule-sec | 25 | EXP |
Physical property data is provided to ChemIDplus by SRC, Inc.