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Dobutamine hydrochloride Structure

Dobutamine hydrochloride

Chemical Properties

Melting point 184-186 C
storage temp.  2-8°C
solubility  Sparingly soluble in water, soluble in methanol, sparingly soluble in ethanol (96 per cent).
form  Solid
pka 9.45(at 25℃)
color  White to Off-White
Water Solubility  Soluble in water or ethanol with warming. Also soluble in methanol
λmax 281nm(MeOH)(lit.)
Merck  14,3395
Stability Solutions are rapidly oxidized at pH 11-13. It is recommended that solutions be freshly prepared and protected from light. Dobutamine hydrochloride is sensitive to light.
InChI InChI=1S/C18H23NO3.ClH/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15;/h4-9,12-13,19-22H,2-3,10-11H2,1H3;1H
InChIKey BQKADKWNRWCIJL-UHFFFAOYSA-N
SMILES C1(O)=CC=C(CCNC(C)CCC2=CC=C(O)C=C2)C=C1O.[H]Cl
CAS DataBase Reference 49745-95-1(CAS DataBase Reference)
FDA UNII 0WR771DJXV
EPA Substance Registry System 1,2-Benzenediol, 4-[2-[[3-(4-hydroxyphenyl)-1-methylpropyl]amino]ethyl]-, hydrochloride (49745-95-1)

Safety

Symbol(GHS) GHS hazard pictogramsGHS hazard pictograms
Signal wordWarning
Hazard statements H302+H312+H332-H361
Precautionary statements P201-P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P308+P313
Hazard Codes  Xn,Xi
Risk Statements  20/21/22-63-36/37/38-R63-R62-R11-R21-R20
Safety Statements  22-26-36/37/39-36/37-S53-S39-S37-S36-S26-S22
WGK Germany  3
HS Code  29222990
Toxicity LD50 i.v. in mice: ~73 mg/kg (Weber, Tuttle)
NFPA 704:
0
3 0

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