4-Methylthiazole, 98%

Name: 4-Methylthiazole
Brand: Chempure

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CAS Number

693-95-8

Molecular Weight

99.15

Formula

C4H5NS

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IUPAC name	4-methyl-1,3-thiazole
inchi	InChI=1S/C4H5NS/c1-4-2-6-3-5-4/h2-3H,1H3
inchi key	QMHIMXFNBOYPND-UHFFFAOYSA-N
molecular formula	C4H5NS
synonyms	4-METHYLTHIAZOLE 693-95-8 4-Methyl-1,3-thiazole Thiazole, 4-methyl- 4-methyl thiazole
Compound Description	4-methylthiazole is a 1,3-thiazole substituted by a methyl group at position 4. It has a role as a Maillard reaction product. 4-Methylthiazole is a metabolite found in or produced by Saccharomyces cerevisiae.

Computed Properties

Molecular Weight:	99.16 g/mol
XLogP3:	1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	99.01427034 g/mol
Monoisotopic Mass:	99.01427034 g/mol
Topological Polar Surface Area:	41.1 Å²
Heavy Atom Count:	6
Formal Charge:	0
Complexity:	46.8
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Flam. Liq. 3 (13.6%) Acute Tox. 4 (99.6%) Skin Irrit. 2 (14.2%) Eye Irrit. 2 (11.3%)
precautionary statement codes	P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501
hazard statements	H226 (13.6%): Flammable liquid and vapor [Warning Flammable liquids] H302 (99.6%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (14.2%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (11.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
hazards summary	Safe when used as a flavoring agent in food. Causes zonal hepatitis and other liver changes in 3-day intermittent intraperitoneal study of rats. An irritant. See Benzothiazole.

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Product No: AA7540

4-Methylthiazole, 98%

Product No: AA7540

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NAME AND IDENTIFIERS

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SAFETY AND HAZARDS

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