3-[[4-[(4-Chlorophenyl)sulfonyl]-4,5-dihydro-1-phenyl-1H-pyrazol-3-yl]oxy]propyl(dimethyl)ammonium methanesulfonate

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Catalog Number

ACM97158457

Product Name

Structure

CAS

97158-45-7

Category

Heterocyclic Organic Compound

Synonyms

EINECS 306-374-4, 3-((4-((4-Chlorophenyl)sulphonyl)-4,5-dihydro-1-phenyl-1H-pyrazol-3-yl)oxy)propyl(dimethyl)ammonium methanesulphonate, 97158-45-7

IUPAC Name

3-[[4-(4-chlorophenyl)sulfonyl-2-phenyl-3,4-dihydropyrazol-5-yl]oxy]-N,N-dimethylpropan-1-amine; methanesulfonic acid

Molecular Weight

518.046520 [g/mol]

Molecular Formula

C21H28ClN3O6S2

Canonical SMILES

C[NH+](C)CCCOC1=NN(CC1S(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3.CS(=O)(=O)[O-]

InChI Key

WORIVDLKTGNAQV-UHFFFAOYSA-N

Boiling Point

589.5ºC at 760mmHg

Flash Point

310.3ºC

EC Number

306-374-4

Exact Mass

517.11100

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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