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M1692

MRS 1845

≥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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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

Biochem/physiol Actions

Store-operated calcium (SOC) channel inhibitor.

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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