Stearoyl chloride
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Stearoyl chloride
structure -
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CAS No:
112-76-5
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Formula:
C18H35ClO
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Chemical Name:
Stearoyl chloride
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Synonyms:
Octadecanoyl chloride;Stearoyl chloride;Stearic acid chloride;Stearic chloride;Stearyl chloride;Octadecanoic acid chloride;Octadecyloyl chloride;Stearyl acid chloride
- Categories:
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CAS No:
Characteristics
17.1
8.96
strongly brown liquid
0.9±0.1 g/cm3
23 °C
215 °C @ Press: 15 Torr
>230 °F
1.453
hydrolysis;SOL IN HYDROCARBONS AND ETHERS
−20°C
0.000106mmHg at 25°C
Oral-rat LD50: 7500 mg/kg
Flammable; decomposes toxic hydrogen chloride gas in case of heat or water
Safety Information
III
8
UN 3261 8/PG 2
2
14-34
26-36/37/39-43-45
RG2162000
C
The warehouse is ventilated, low temperature and dry; stored separately from oxidants and alkalis
P280-P305 + P351 + P338-P310
H314
|Danger|H290 (55.28%): May be corrosive to metals [Warning Corrosive to Metals]|P234, P260, P261, P264, P272, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P332+P313, P333+P313, P362, P363, P390, P404, P405, and P501|Aggregated GHS information provided by 161 companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H315: Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362
Stearoyl chloride Use and Manufacturing
Mix stearic acid with dimethylformamide, add a catalyst, and react with phosgene. Then nitrogen gas is used to drive off the hydrogen chloride and excess phosgene generated by the reaction, and the vacuum distillation is performed to obtain the finished product. Raw material consumption quota: 970kg/t of stearic acid, 420kg/t of phosgene (98%), 10kg/t of dimethylformamide (98%), and 400kg/t of liquid alkali (30%).
Usually used in the synthesis of tumor-associated macrophages and antitumor agents.
Octadecanoyl chloride: ACTIVE
Computed Properties
Molecular Weight:302.9
XLogP3:8.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:16
Exact Mass:302.2376434
Monoisotopic Mass:302.2376434
Topological Polar Surface Area:17.1
Heavy Atom Count:20
Complexity:204
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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