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B016

Benoxathian hydrochloride

solid

Synonym(s):

2-[[[2-(2,6-Dimethoxyphenoxy)ethyl]-amino]-methyl]-1,4-benzoxathian hydrochloride

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About This Item

Empirical Formula (Hill Notation):
C19H23NO4S · HCl
CAS Number:
Molecular Weight:
397.92
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
12352202
MDL number:
Form:
solid
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form

solid

color

white

solubility

H2O: soluble (Aqueous solutions may be stored for several weeks at -20 °C.), ethanol: soluble, isopropanol: soluble

SMILES string

Cl.COc1cccc(OC)c1OCCNCC2CSc3ccccc3O2

InChI

1S/C19H23NO4S.ClH/c1-21-16-7-5-8-17(22-2)19(16)23-11-10-20-12-14-13-25-18-9-4-3-6-15(18)24-14;/h3-9,14,20H,10-13H2,1-2H3;1H

InChI key

OWRADFDDJVNMGL-UHFFFAOYSA-N

Gene Information

Biochem/physiol Actions

Selective α1-adrenoceptor antagonist.

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O003SML2911N7510
description

solid

description

solid

description

≥97% (HPLC)

description

powder, ≥98%

form

solid

form

solid

form

powder

form

powder

solubility

H2O: soluble (Aqueous solutions may be stored for several weeks at -20 °C.), isopropanol: soluble, ethanol: soluble

solubility

methanol: 7.6 mg/mL (do not store in ethanolic solution; methanolic solutions may be stored for several weeks at 4 °C), H2O: 7.5 mg/mL (aqueous solutions should be promptly used)

solubility

H2O: 2 mg/mL, clear

solubility

methanol: soluble, 0.1 M NaOH: insoluble, H2O: slightly soluble, DMSO: ~1 mg/mL

color

white

color

white

color

white to beige

color

yellow

Gene Information

human ... ADRA1A(148), ADRA1B(147), ADRA1D(146)

Gene Information

-

Gene Information

-

Gene Information

human ... CACNA1C(775), CACNA1D(776), CACNA1F(778), CACNA1S(779)


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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