H6511
3-Heptanone
98%
Synonym(s):
Butyl ethyl ketone, Ethyl butyl ketone
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About This Item
Linear Formula:
CH3(CH2)3COC2H5
CAS Number:
Molecular Weight:
114.19
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-388-1
Beilstein/REAXYS Number:
506161
MDL number:
Assay:
98%
Quality Level
assay
98%
refractive index
n20/D 1.408 (lit.)
bp
146-149 °C (lit.)
mp
−39 °C (lit.)
density
0.818 g/mL at 25 °C (lit.)
SMILES string
CCCCC(=O)CC
InChI
1S/C7H14O/c1-3-5-6-7(8)4-2/h3-6H2,1-2H3
InChI key
NGAZZOYFWWSOGK-UHFFFAOYSA-N
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wgk
WGK 2
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2
Storage Class
3 - Flammable liquids
flash_point_f
100.4 °F - closed cup
flash_point_c
38 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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J L O'Donoghue et al.
Toxicology and applied pharmacology, 72(2), 201-209 (1984-02-01)
Ethyl n-butyl ketone (EBK, 3-heptanone) has not been reported to produce neurotoxicity in previous studies when it was given by oral or inhalation routes. In the present study, EBK given by gavage at 2 g/kg/day, 5 days/week for 14 weeks
Effects of methyl n-butyl ketone and ethyl n-butyl ketone on fixed ratio, fixed interval performance of rats.
I Geller et al.
Proceedings of the Western Pharmacology Society, 24, 105-108 (1981-01-01)
Paweł Mochalski et al.
Cell biochemistry and biophysics, 71(1), 323-329 (2014-08-16)
Gas chromatography with mass spectrometric detection combined with head-space needle trap extraction as the pre-concentration technique was applied to identify and quantify volatile organic compounds released or metabolised by human umbilical vein endothelial cells. Amongst the consumed species there were