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经验公式(希尔记法):
C9H7N
化学文摘社编号:
分子量:
129.16
PubChem Substance ID:
UNSPSC Code:
12352210
Beilstein/REAXYS Number:
107477
MDL number:
Assay:
≥95.0%
Grade:
JIS special grade
Bp:
113-114 °C/11 mmHg (lit.), 237 °C (lit.)
Vapor pressure:
0.07 mmHg ( 20 °C)
SMILES string
c1ccc2ncccc2c1
InChI
1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H
InChI key
SMWDFEZZVXVKRB-UHFFFAOYSA-N
grade
JIS special grade
vapor density
4.5 (vs air)
vapor pressure
0.07 mmHg ( 20 °C)
assay
≥95.0%
form
liquid
autoignition temp.
896 °F
availability
available only in Japan
dilution
(for analytical testing)
bp
113-114 °C/11 mmHg (lit.), 237 °C (lit.)
mp
−17-−13 °C (lit.)
density
1.093 g/mL at 25 °C (lit.)
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signalword
Danger
Hazard Classifications
Acute Tox. 3 Oral - Acute Tox. 4 Dermal - Aquatic Chronic 2 - Carc. 1B - Eye Irrit. 2 - Muta. 2 - Skin Irrit. 2
存储类别
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 2
flash_point_f
221.0 °F
flash_point_c
105 °C
法规信息
新产品
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Dalton transactions (Cambridge, England : 2003), 41(38), 11753-11759 (2012-08-21)
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Dalton transactions (Cambridge, England : 2003), 41(38), 11776-11782 (2012-08-21)
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Journal of medicinal chemistry, 56(13), 5231-5246 (2013-04-17)
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