vapor density
2.1 (vs air)
vapor pressure
10 mmHg ( 147 °C), 14.9 mmHg ( 20 °C)
assay
≥99.5% (GC)
autoignition temp.
700 °F
expl. lim.
13.7 %
refractive index
n20/D 1.384 (lit.), n20/D 1.385
bp
97 °C (lit.)
mp
−127 °C (lit.)
density
0.804 g/mL at 25 °C (lit.)
λ
1 cm path, H2O reference
UV absorption
λ: 240 nm Amax: 0.1, λ: 260 nm Amax: 0.04, λ: 280 nm Amax: 0.02, λ: 300 nm Amax: 0.01
suitability
in accordance for luminescence, suitable for luminescence
SMILES string
CCCO
InChI
1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChI key
BDERNNFJNOPAEC-UHFFFAOYSA-N
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signalword
Danger
hcodes
Hazard Classifications
Eye Dam. 1 - Flam. Liq. 2 - STOT SE 3
target_organs
Central nervous system
存储类别
3 - Flammable liquids
wgk
WGK 1
flash_point_f
71.6 °F - closed cup
flash_point_c
22 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
此项目有
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
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
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
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