octopamine

Names

[ CAS No. ]:
104-14-3

[ Name ]:
octopamine

[Synonym ]:
Norsynephrine
p-Hydroxyphenylethanolamine
PARA-OCTOPAMINE
Octopamine
AURORA KA-7795
EINECS 203-179-5
RARECHEM AL BW 0555
ND 50
MFCD00044589

Chemical & Physical Properties

[ Density]:
1.249g/cm3

[ Boiling Point ]:
360.7ºC at 760mmHg

[ Molecular Formula ]:
C₈H₁₁NO₂

[ Molecular Weight ]:
153.17800

[ Flash Point ]:
12 °C

[ Exact Mass ]:
153.07900

[ PSA ]:
66.48000

[ LogP ]:
1.08460

[ Vapour Pressure ]:
7.82E-06mmHg at 25°C

[ Index of Refraction ]:
1.614

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DN7350000

CHEMICAL NAME :: Benzyl alcohol, alpha-(aminomethyl)-p-hydroxy-

CAS REGISTRY NUMBER :: 104-14-3

BEILSTEIN REFERENCE NO. :: 1211019

LAST UPDATED :: 199612

DATA ITEMS CITED :: 9

MOLECULAR FORMULA :: C8-H11-N-O2

MOLECULAR WEIGHT :: 153.20

WISWESSER LINE NOTATION :: Z1YQR DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 1240 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 1350 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 350 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 4200 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 600 mg/kg

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

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 106,341,1952

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2070 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 75 mg/kg

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

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 106,341,1952

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

ROUTE OF EXPOSURE :: Intracerebral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2100 mg/kg

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

REFERENCE :: NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 64(4),140S,1968

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 200 mg/kg

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

REFERENCE :: AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 101,81,1955

Safety Information

[ RIDADR ]:
3249

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

[ HS Code ]:
2922509090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

5-(4-methoxy-phenyl)-oxazolidin-2-one
Tyramine
(R)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)butyramide
tert-butyl (R)-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)carbamate
BOC-ALPHA-AMINOMETHYL-4-HYDROXYBENZYL ALCOHOL
N-Boc-2-(4-methoxy)phenylethylamine
4-hydroxybenzaldehyde
2,2-Diethoxyethanamine
Phenol
2-Bromo-4'-hydroxyacetophenone

DownStream

Tyramine
4-Hydroxybenzoic acid
BOC-ALPHA-AMINOMETHYL-4-HYDROXYBENZYL ALCOHOL
N-Feruloyloctopamine
N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]butanamide

Customs

[ 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%

Related Compounds

octopamine
octopamine
2-octopamine
Octopamine-d3
Octopamine HCL
L-m-Octopamine
2-[2-Fluoro-4'-(trifluoromethyl)-1,1'-biphenyl-4-yl]-2-methylpropionic acid
(4-hydroxy-3,5-dimethoxyphenyl)(6-methoxy-1H-indol-3-yl)methanone
6-[3-(2-Trifluoromethyl-pyrimidin-4-yl)-1h-pyrazol-4-yl]-quinoline
3-Methyl-2-(2,4,6-trimethylphenyl)butanoic acid
Tert-butyl [6-(imidazo[1,2-d][1,2,4]thiadiazol-3-ylamino)hexyl][(2-nitrophenyl)sulfonyl]carbamate
4-Chloromethyl-3-methyl-5-phenyl-isoxazole
3-Hydrazino-6-(2-methylphenyl)pyridazine
1-(1-Ethynylcyclohexyl)-2,2,5,5-tetramethyl-1,2,5-azadisilolidine
2-[[(2-Chlorophenyl)methylamino]methyl]aniline
SD4QV3DF2R

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