1-(2-ISOTHIOCYANATOETHYL)-4-[2-(3,4-DIHYDRO-2H-1-BENZOPYRAN-6-YL)-5- OXAZOLYL]PYRIDINIUM BROMIDE

Modify Date: 2025-08-27 12:57:25

1-(2-ISOTHIOCYANATOETHYL)-4-[2-(3,4-DIHYDRO-2H-1-BENZOPYRAN-6-YL)-5- OXAZOLYL]PYRIDINIUM BROMIDE structure	Common Name	1-(2-ISOTHIOCYANATOETHYL)-4-[2-(3,4-DIHYDRO-2H-1-BENZOPYRAN-6-YL)-5- OXAZOLYL]PYRIDINIUM BROMIDE
	CAS Number	155863-02-8	Molecular Weight	444.34500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₀H₁₈BrN₃O₂S	Melting Point	N/A
	MSDS	Chinese USA	Flash Point	N/A
	Symbol	GHS07	Signal Word	Warning

Name	2-(3,4-dihydro-2H-chromen-6-yl)-5-[1-(2-isothiocyanatoethyl)pyridin-1-ium-4-yl]-1,3-oxazole,bromide
Synonym	More Synonyms

Molecular Formula	C₂₀H₁₈BrN₃O₂S
Molecular Weight	444.34500
Exact Mass	443.03000
PSA	83.59000
LogP	0.72790
InChIKey	DKHIKMKBZZKQPN-UHFFFAOYSA-M
SMILES	S=C=NCC[n+]1ccc(-c2cnc(-c3ccc4c(c3)CCCO4)o2)cc1.[Br-]

MSDS(Chinese)

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
RIDADR	NONH for all modes of transport
HS Code	2934999090

HS Code	2934999090
Summary	2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Litak, P.T.;Kauffman, J.M.

J. Heterocycl. Chem. 31 , 457, (1994)

1-(2-Isothiocyanatoethyl)-4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]pyridinium bromide

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