2-(3,4,5-Trimethoxyphenyl)-4,5-dihydro-1,3-thiazole

Modify Date: 2025-09-14 08:41:07

2-(3,4,5-Trimethoxyphenyl)-4,5-dihydro-1,3-thiazole structure	Common Name	2-(3,4,5-Trimethoxyphenyl)-4,5-dihydro-1,3-thiazole
	CAS Number	96159-92-1	Molecular Weight	253.31700
	Density	1.23g/cm3	Boiling Point	385.5ºC at 760mmHg
	Molecular Formula	C₁₂H₁₅NO₃S	Melting Point	N/A
	MSDS	N/A	Flash Point	186.9ºC

Name	2-(3,4,5-Trimethoxyphenyl)-4,5-dihydro-1,3-thiazole

Density	1.23g/cm3
Boiling Point	385.5ºC at 760mmHg
Molecular Formula	C₁₂H₁₅NO₃S
Molecular Weight	253.31700
Flash Point	186.9ºC
Exact Mass	253.07700
PSA	65.35000
LogP	1.64140
Index of Refraction	1.57
InChIKey	QXBQKBAGRFODPD-UHFFFAOYSA-N
SMILES	COc1cc(C2=NCCS2)cc(OC)c1OC

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ4272770

CHEMICAL NAME :: Thiazole, 4,5-dihydro-2-(3,4,5-trimethoxyphenyl)-

CAS REGISTRY NUMBER :: 96159-92-1

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H15-N-O3-S

MOLECULAR WEIGHT :: 253.34

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 20,16,1985

HS Code	2934100090

2-Aminoethanethiol

CAS#:60-23-1

3,4,5-Trimethox...

CAS#:1885-35-4

~58%

2-(3,4,5-Trimet...

CAS#:96159-92-1

Literature: Robbe; Fernandez; Chapat; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 1 p. 16 - 24

3,4,5-Trimethox...

CAS#:50606-35-4

2-Aminoethanethiol

CAS#:60-23-1

~94%

2-(3,4,5-Trimet...

CAS#:96159-92-1

Literature: Kamila, Sukanta; Biehl, Edward R. Journal of Heterocyclic Chemistry, 2007 , vol. 44, # 2 p. 407 - 409

HS Code	2934100090
Summary	2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

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CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.