3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol
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![3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ace45ededecc49368b19be9e618a2e67.png "3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol")
3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol
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CAS No:
137056-72-5
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Formula:
C29H50N2O2.ClH
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Chemical Name:
3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol
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Synonyms:
3BETA[N-(N',N'-DIMETHYLAMINOETHANE)-CARBAMOYL]CHOLESTEROL;3BETA[N-(N,N-DIMETHYLAMINOETHANECARBAMOYL CHOLESTEROL;3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol;3b[N-(N',N'-DiMethylaMinoethane)-carbaMoyl]cholesterol;3β-{N-[2-(Dimethylamino)ethyl]carbamoyl}cholesterol;Cholesteryl N-(2-dimethylaminoethyl)carbamate;3β-[N-(N',N'-Dimethylaminoethane)-carbamoyl]cholesterol≥ 95% (HPLC)
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CAS No:
Characteristics
41.6
1.01±0.1 g/cm3(Predicted)
107.5-108.5 °C(Solv: ethanol (64-17-5))
578.1±39.0 °C(Predicted)
-20°C
Safety Information
3
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:500.8
XLogP3:9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:500.43417903
Monoisotopic Mass:500.43417903
Topological Polar Surface Area:41.6
Heavy Atom Count:36
Complexity:791
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3â[N-(N'',N''-Dimethylaminoethane)-carbamoyl]cholesterol
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