calcium 2-chloro-5-[[4,5-dihydro-3-methyl-5-oxo-1-(3-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzenesulphonate

Modify Date: 2025-10-22 20:32:00

calcium 2-chloro-5-[[4,5-dihydro-3-methyl-5-oxo-1-(3-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzenesulphonate structure	Common Name	calcium 2-chloro-5-[[4,5-dihydro-3-methyl-5-oxo-1-(3-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzenesulphonate
	CAS Number	85605-12-5	Molecular Weight	510.94200
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₆H₁₁CaClN₄O₇S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	calcium,2-chloro-5-[[3-methyl-5-oxo-1-(3-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonate

Molecular Formula	C₁₆H₁₁CaClN₄O₇S₂
Molecular Weight	510.94200
Exact Mass	509.93800
PSA	188.55000
LogP	3.68540
InChIKey	UBBVWJHXZPOXOJ-UHFFFAOYSA-L
SMILES	CC1=NN(c2cccc(S(=O)(=O)[O-])c2)C(=O)C1N=Nc1ccc(Cl)c(S(=O)(=O)[O-])c1.[Ca+2]

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