27591-01-1

27591-01-1 structure

27591-01-1 structure

Name: bunolol
Chemical Name: 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one
CAS Number: 27591-01-1
Molecular Formula: C₁₇H₂₅NO₃
Molecular Weight: 291.38500
Create Date: 2018-03-05 08:00:00
Modify Date: 2024-01-09 15:49:13

Name	5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one
Synonyms	Bunolol Bunololum Bunololo

Density	1.109g/cm3
Boiling Point	464.4ºC at 760mmHg
Molecular Formula	C₁₇H₂₅NO₃
Molecular Weight	291.38500
Flash Point	234.7ºC
Exact Mass	291.18300
PSA	58.56000
LogP	2.72430
Vapour Pressure	2.01E-09mmHg at 25°C
Index of Refraction	1.542

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QK4400000

CHEMICAL NAME :: 1(2H)-Naphthalenone, 3,4-dihydro-5-(3-(tert-butylamino)-2-hydroxypropoxy)-

CAS REGISTRY NUMBER :: 27591-01-1

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H25-N-O3

MOLECULAR WEIGHT :: 291.43

WISWESSER LINE NOTATION :: L66 BVT&J GO1YQ1MX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 46 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 27,1022,1977

HS Code	2922509090

28315-93-7 structure

28315-93-7

75-64-9 structure

75-64-9

106-89-8 structure

106-89-8

~%

27591-01-1 structure

27591-01-1

Literature: Schwender; Farber; Blaum; Shavel Jr. Journal of medicinal chemistry, 1970 , vol. 13, # 4 p. 684 - 688

Precursor 3
28315-93-7 75-64-9 106-89-8
DownStream 0

HS Code	2922509090
Summary	2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%