L-HISTIDINE,N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-1-[(4-METHYLPHENYL)SULFONYL]-

Modify Date: 2025-08-26 09:21:11

L-HISTIDINE,N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-1-[(4-METHYLPHENYL)SULFONYL]- structure	Common Name	L-HISTIDINE,N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-1-[(4-METHYLPHENYL)SULFONYL]-
	CAS Number	178925-54-7	Molecular Weight	580.59200
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₅H₂₀N₆O₇S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	4-[2-(1,3-benzothiazol-2-yl)-5-[4-(2-sulfoethylcarbamoyl)phenyl]-1H-tetrazol-1-ium-3-yl]-3-methoxybenzoic acid
Synonym	More Synonyms

Molecular Formula	C₂₅H₂₀N₆O₇S₂
Molecular Weight	580.59200
Exact Mass	580.08300
PSA	216.93000
LogP	3.27420
InChIKey	QZHPOWUOLXLXGX-UHFFFAOYSA-O
SMILES	COc1cc(C(=O)O)ccc1N1N=C(c2ccc(C(=O)NCCS(=O)(=O)O)cc2)[NH2+]N1c1nc2ccccc2s1

Hazard Codes	Xn:Harmful;
Risk Phrases	R20/21/22;R36/37/38
Safety Phrases	S26-S36

MFCD09751263

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