AG000WB1

1314977-20-2 | 5-Thiazolemethanol, 2-amino-4-(trifluoromethyl)-

AG000WB1

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CAS Number	1314977-20-2
Catalog Number	AG000WB1(AGN-PC-0WAN54)
Chemical Name	5-Thiazolemethanol, 2-amino-4-(trifluoromethyl)-
IUPAC Name	[2-amino-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
InChI	InChI=1S/C5H5F3N2OS/c6-5(7,8)3-2(1-11)12-4(9)10-3/h11H,1H2,(H2,9,10)
InChI Key	YCFRUGDBRCSGCS-UHFFFAOYSA-N
MDL Number	MFCD09250889
Molecular Formula	C5H5F3N2OS
Molecular Weight	198.1662
SMILES	OCC1=C(C(F)(F)F)N=C(N)S1
Synonyms	(2-Amino-4-(trifluoromethyl)thiazol-5-yl)methanol, 1314977-20-2, AK138950, [2-amino-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanol, KS-00000RSB, DTXSID60717283, FCH865492, MFCD09250889, ZINC95830489, AKOS006331341, CS-W006976, DS-6494, AJ-134631, AX8260555, ST2402179, 4CH-017673, 5-Thiazolemethanol, 2-amino-4-(trifluoromethyl)-,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.007g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	198.163g/mol
Monoisotopic Mass	198.007g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number