Bucetin
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Bucetin
structure -
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CAS No:
1083-57-4
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Formula:
C12H17NO3
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Chemical Name:
Bucetin
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Synonyms:
Butanamide,N-(4-ethoxyphenyl)-3-hydroxy-;p-Butyrophenetidide,3-hydroxy-;N-(4-Ethoxyphenyl)-3-hydroxybutanamide;Bucetin;3-Hydroxy-p-butyrophenetidide;β-Hydroxybutyric acid p-phenetidide;p-Ethoxy-N-(β-hydroxybutyryl)aniline;Betadid;N-(β-Hydroxybutyryl)-p-phenetidine;(±)-Bucetin;156674-12-3
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CAS No:
Description
Bucetin (3-Hydroxy-p-butyrophenetidide) is an analgesic and antipyretic compound.
Bucetin is an organic molecular entity.|Bucetin is an analgesic and antipyretic medication which was approved for use in Germany but was withdrawn from the market in 1986 due to renal toxicity caused by the medication.
Bucetin Basic Attributes
223.27
223.27
214-109-8
1Z23WB033I|PLF54F8S2F
759243|320045
DTXSID6020721
N - Nervous system
2924299090
Characteristics
58.6
1.8
1.1223 (rough estimate)
160 °C
364.56°C (rough estimate)
216ºC
1.5300 (estimate)
2.77E-08mmHg at 25°C
LD50 in mice (mg/kg): 790 i.p., 2800 orally (Fujimura)
152.5 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Safety Information
Ⅲ
2811
3
45-46-20/21/22
53-22-36/37/39-45
EU0900000
T
P201-P280-P308 + P313
H312-H332-H350
|Danger|H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]|P201, P202, P261, P271, P280, P281, P302+P352, P304+P312, P304+P340, P308+P313, P312, P322, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Bucetin Use and Manufacturing
Bucetin is an antipyretic and analgesic drug that is chemically similar to phenacetin (P294580). The use of Bucetin has been withdrawn due to renal toxicity.
Butanamide, N-(4-ethoxyphenyl)-3-hydroxy-: INACTIVE
Pharmaceuticals
Computed Properties
Molecular Weight:223.27
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:223.12084340
Monoisotopic Mass:223.12084340
Topological Polar Surface Area:58.6
Heavy Atom Count:16
Complexity:212
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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