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MRS 1845

Name: MRS 1845
Brand: SIGMA

≥95% (HPLC), solid

Synonym(s):

N-Propargylnitrendipene

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About This Item

Empirical Formula (Hill Notation):

C₂₁H₂₂N₂O₆

CAS Number:

544478-19-5

Molecular Weight:

398.41

NACRES:

NA.77

PubChem Substance ID:

24278801

UNSPSC Code:

12352200

MDL number:

MFCD06798381

Assay:

≥95% (HPLC)

Form:

solid

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Properties

Quality Segment

100

assay

≥95% (HPLC)

form

solid

color

yellow

solubility

DMSO: soluble ≥10 mg/mL at 60 °C, H₂O: insoluble

storage temp.

2-8°C

SMILES string

CCOC(=O)C1=C(C)N(CC#C)C(C)=C(C1c2cccc(c2)[N+]([O-])=O)C(=O)OC

InChI

1S/C21H22N2O6/c1-6-11-22-13(3)17(20(24)28-5)19(18(14(22)4)21(25)29-7-2)15-9-8-10-16(12-15)23(26)27/h1,8-10,12,19H,7,11H2,2-5H3

InChI key

BITHABUTZRAUGT-UHFFFAOYSA-N

Description

Biochem/physiol Actions

Store-operated calcium (SOC) channel inhibitor.

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This Item	G0544	P0618	G7048
Sigma-Aldrich M1692 MRS 1845	Sigma-Aldrich G0544 GR 103691	Sigma-Aldrich P0618 cis-8-Hydroxy-3-(n-propyl)-1,2,3a,4,5,9b-hexahydro-1H-benz[e]indole hydrobromide	Sigma-Aldrich G7048 Proguanil hydrochloride
form solid	form solid	form solid	form solid
assay ≥95% (HPLC)	assay ≥98% (HPLC)	assay ≥98% (HPLC)	assay ≥95% (HPLC)
Quality Level 100	Quality Level 100	Quality Level -	Quality Level 100
storage temp. 2-8°C	storage temp. 2-8°C	storage temp. 2-8°C	storage temp. 2-8°C
solubility DMSO: soluble ≥10 mg/mL at 60 °C, H₂O: insoluble	solubility DMSO: soluble >5 mg/mL at 60 °C	solubility H₂O: soluble ~10 mg/mL at 60 °C (Sonicate), DMSO: soluble 12 mg/mL	solubility acetonitrile: water: ~1 mg/mL (60/40)
color yellow	color white	color light brown	color -

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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