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M1692

Sigma-Aldrich

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
MDL number:
MFCD06798381
UNSPSC Code:
12352200
PubChem Substance ID:
24278801
NACRES:
NA.77

Quality Level

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 Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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