AG001P02

15679-11-5 | 4-tert-Butyl-2-methylthiazole

AG001P02

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CAS Number	15679-11-5
Catalog Number	AG001P02(AGN-PC-0KK79X)
Chemical Name	4-tert-Butyl-2-methylthiazole
IUPAC Name	4-tert-butyl-2-methyl-1,3-thiazole
InChI	InChI=1S/C8H13NS/c1-6-9-7(5-10-6)8(2,3)4/h5H,1-4H3
InChI Key	IHLQWPDUYYFCSQ-UHFFFAOYSA-N
MDL Number	MFCD00051643
Molecular Formula	C8H13NS
Molecular Weight	155.2605
SMILES	CC1SC=C(C(C)(C)C)N=1
Synonyms	4-tert-Butyl-2-methylthiazole, 15679-11-5, 4-tert-butyl-2-methyl-1,3-thiazole, 4-(tert-butyl)-2-methylthiazole, 4-(tert-butyl)-2-methyl-1,3-thiazole, MFCD00051643, ACMC-20amar, AC1MC3VS, Thiazole, 4-(1,1-dimethylethyl)-2-methyl-, 4-t-Butyl-2-methylthiazole, SCHEMBL77644, 2-Methyl-4-tert-butylthiazole, CTK4C9186, DTXSID30370884, IHLQWPDUYYFCSQ-UHFFFAOYSA-N, ZINC159531, 4925AD, SBB087087, AKOS006229756, NE27703, QC-6164, VT10145, TS-02072, ZB007255, TC-168570, Thiazole,4-(1,1-dimethylethyl)-2-methyl-, FT-0619484, ST50824520, A809771, I14-112901, Z204235642, C8H13NS, Thiazole, 4-tert-butyl-2-methyl-, ZINC00159531, ACN-041579, CID2735687,

Complexity	117
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.077g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	155.259g/mol
Monoisotopic Mass	155.077g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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