5-[4,5-dihydro-5-oxo-3-[(1-oxohexadecyl)amino]-1H-pyrazol-1-yl]-2-phenoxybenzenesulphonic acid

Modify Date: 2025-11-11 15:54:20

5-[4,5-dihydro-5-oxo-3-[(1-oxohexadecyl)amino]-1H-pyrazol-1-yl]-2-phenoxybenzenesulphonic acid structure	Common Name	5-[4,5-dihydro-5-oxo-3-[(1-oxohexadecyl)amino]-1H-pyrazol-1-yl]-2-phenoxybenzenesulphonic acid
	CAS Number	94349-41-4	Molecular Weight	585.75500
	Density	1.21g/cm3	Boiling Point	N/A
	Molecular Formula	C₃₁H₄₃N₃O₆S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	5-[3-(hexadecanoylamino)-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid
Synonym	More Synonyms

Density	1.21g/cm3
Molecular Formula	C₃₁H₄₃N₃O₆S
Molecular Weight	585.75500
Exact Mass	585.28700
PSA	133.75000
LogP	8.84790
Index of Refraction	1.582
InChIKey	SSTSDBMLLNZAPW-UHFFFAOYSA-N
SMILES	CCCCCCCCCCCCCCCC(=O)NC1=NN(c2ccc(Oc3ccccc3)c(S(=O)(=O)O)c2)C(=O)C1

5-(4,5-Dihydro-5-oxo-3-((1-oxohexadecyl)amino)-1H-pyrazol-1-yl)-2-phenoxybenzenesulphonic acid

5-[4,5-DIHYDRO-5-OXO-3-[(1-OXOHEXADECYL)AMINO]-1H-PYRAZOL-1-YL]-2-PHENOXYBENZENESULFONIC ACID

EINECS 305-158-7

Names