Product Name: Befunolol hydrochloride (CAS NO.39543-79-8)
Molecular Formula: C16H21NO4•ClH
Molecular Weight: 327.84g/mol
Mol File: 39543-79-8.mol
Boiling point: 459.3°C at 760 mmHg
Flash Point: 231.6°C
Density: 1.158g/cm3
H-Bond Donor: 2
H-Bond Acceptor: 5
Structure Descriptors of Befunolol hydrochloride (CAS NO.39543-79-8):
IUPAC Name: [3-[(2-acetyl-1-benzofuran-7-yl)oxy]-2-hydroxypropyl]-propan-2-ylazanium
chloride
Canonical SMILES: CC(C)[NH2+]CC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O.[Cl-]
InChI: InChI=1S/C16H21NO4.ClH/c1-10(2)17-8-13(19)9-20-14-6-4-5-12-7-15(11(3)18)
21-16(12)14;/h4-7,10,13,17,19H,8-9H2,1-3H3;1H
InChIKey: TVVTWOGRPVJKDJ-UHFFFAOYSA-N
1. | orl-rat LD50:922 mg/kg | KSRNAM Kiso to Rinsho. Clinical Report, 13 (1979),4138. | ||
2. | ipr-rat LD50:182 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. | ||
3. | scu-rat LD50:498 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. | ||
4. | orl-mus LD50:950 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. | ||
5. | ipr-mus LD50:184 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. | ||
6. | scu-mus LD50:434 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. | ||
7. | ivn-mus LD50:65 mg/kg | IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies, 14 (1983),484. |
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion and subcutaneous routes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx and HCl. A beta-adrenergic blocker.
Befunolol hydrochloride ,its CAS NO. is 39543-79-8,the synonyms is Glauconex ; Bentox ; Bentos ; Befunolol HCl ; Bentos (TN) ; BFE 60 ; Befunolol hydrochloride (JAN) ; 39552-01-7 (Parent) ; CID38286 .
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