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经验公式(希尔记法):
C9H9D5O
化学文摘社编号:
分子量:
143.24
NACRES:
NA.24
PubChem Substance ID:
UNSPSC Code:
12352116
MDL number:
Isotopic purity:
97 atom % D
Assay:
95% (CP)
Mass shift:
M+5
Form:
liquid
InChI
1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3/i4D,5D2,6D2
SMILES string
[2H]C1=C(C)C([2H])([2H])C(C)(C)C([2H])([2H])C1=O
InChI key
HJOVHMDZYOCNQW-FIFBNPHPSA-N
isotopic purity
97 atom % D
assay
95% (CP)
form
liquid
technique(s)
mass spectrometry (MS): suitable
bp
213-214 °C (lit.)
mp
-8 °C (lit.)
density
0.956 g/mL at 25 °C
mass shift
M+5
storage temp.
−20°C
Quality Level
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
signalword
Warning
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
10 - Combustible liquids
wgk
WGK 1
flash_point_f
204.8 °F - closed cup
flash_point_c
96.0 °C - closed cup
法规信息
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