138509
3-氯甲苯
98%
别名:
1-Chloro-3-methylbenzene, 1-Methyl-3-chlorobenzene, 3-Chloro-1-methylbenzene, 3-Methylchlorobenzene, 3-Methylphenyl chloride, m-Chlorotoluene, m-Methylchlorobenzene, m-Tolyl chloride
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线性分子式:
CH3C6H4Cl
化学文摘社编号:
分子量:
126.58
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-580-5
Beilstein/REAXYS Number:
1903632
MDL number:
Assay:
98%
Form:
liquid
InChI key
OSOUNOBYRMOXQQ-UHFFFAOYSA-N
InChI
1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3
SMILES string
Cc1cccc(Cl)c1
assay
98%
form
liquid
Quality Level
bp
160-162 °C (lit.)
mp
−48 °C (lit.)
density
1.072 g/mL at 25 °C (lit.)
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Application
3-Chlorotoluene was used as catalyst in the synthesis of glycidyl methacrylate grafted multi-walled carbon nanotubes/polypropylene nanocomposites. It was used to study paramagnetic contributions from dioxygen to solute proton spin-lattice relaxation rate constants for a series of aromatic hydrocarbons and drug molecule fragments.
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Aquatic Chronic 2 - Flam. Liq. 3
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
125.6 °F - closed cup
flash_point_c
52 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
Solvation and intermolecular exploration of drug molecule fragments.
Fumino K, et al.
Journal of Solution Chemistry, 36(6), 715-722 (2007)
Influence of Glycidyl Methacrylate Grafted Multi-walled Carbon Nanotubes on Viscoelastic Behaviors of Polypropylene Nanocomposites.
Shim Y-S and Park S-J.
Carbon Letters, 11(4), 311-315 (2010)
A A Toropov et al.
European journal of medicinal chemistry, 43(4), 714-740 (2007-07-17)
Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors. Statistical characteristics of the best model (vitamins) are the
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