vapor density
1.11 (vs air)
vapor pressure
410 mmHg ( 50 °C), 97.68 mmHg ( 20 °C)
assay
≥99.8% (GC)
autoignition temp.
725 °F
expl. lim.
36 %
impurities
≤0.1% water
evapn. residue
≤0.0001%
refractive index
n20/D 1.329
bp
64.7 °C (lit.)
mp
−98 °C (lit.)
density
0.791 g/mL at 25 °C (lit.)
SMILES string
CO
InChI
1S/CH4O/c1-2/h2H,1H3
InChI key
OKKJLVBELUTLKV-UHFFFAOYSA-N
Application
根据 EPA 吹扫和捕集方法 601、624 和 8240，用于GC-MS 分析水和土壤沉积物样品中的挥发性有机物（2-丁酮 ≤10μg/l）
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Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Flam. Liq. 2 - STOT SE 1
target_organs
Eyes
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
49.5 °F - closed cup
flash_point_c
9.7 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves
法规信息
新产品
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Alfonso Pérez-Garrido et al.
Bioorganic & medicinal chemistry, 17(2), 896-904 (2008-12-06)
This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoretical molecular descriptors, calculated solely from the molecular structure of the compounds under investigation
Michael H Abraham et al.
European journal of medicinal chemistry, 43(3), 478-485 (2007-06-05)
Values of in vitro gas to lung partition coefficients, K(lung), of VOCs have been collected from the literature. For 44 VOCs, application of the Abraham solvation equation to log K(lung) yielded a correlation with R(2)=0.968 and S.D.=0.25 log units. Combination
Giulia Caron et al.
Journal of medicinal chemistry, 48(9), 3269-3279 (2005-04-29)
Growing interest in the use of both the logarithm of the partition coefficient of the neutral species in the alkane/water system (log P(N)(alk)) and the difference between log P(N)(oct) (the logarithm of the partition coefficient of the neutral species in