AG003M6Z

942631-50-7 | 5-(Boc-amino)thiazole

AG003M6Z

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CAS Number	942631-50-7
Catalog Number	AG003M6Z(AGN-PC-09T64G)
Chemical Name	5-(Boc-amino)thiazole
IUPAC Name	tert-butyl N-(1,3-thiazol-5-yl)carbamate
InChI	InChI=1S/C8H12N2O2S/c1-8(2,3)12-7(11)10-6-4-9-5-13-6/h4-5H,1-3H3,(H,10,11)
InChI Key	FFBWDCMWXFIZAT-UHFFFAOYSA-N
MDL Number	MFCD11977627
Molecular Formula	C8H12N2O2S
Molecular Weight	200.2581
SMILES	O=C(OC(C)(C)C)NC1=CN=CS1
Synonyms	5-(BOC-AMINO)THIAZOLE, 942631-50-7, TERT-BUTYL THIAZOL-5-YLCARBAMATE, tert-butyl N-(1,3-thiazol-5-yl)carbamate, tert-butyl 1,3-thiazol-5-ylcarbamate, PubChem20206, SCHEMBL3712591, CTK5H6137, DTXSID70700601, FFBWDCMWXFIZAT-UHFFFAOYSA-N, 6099AC, ANW-72637, KM3270, MFCD11977627, ZINC42684380, AKOS015950578, RP25792, TRA0013178, AS-31495, SY006001, AB1000646, AJ-104556, TC-161382, MFCD11977627 (97+%), J-524821, Z2205958666, null, C8H12N2O2S, tert-butylthiazol-5-ylcarbamate, N/A,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.062g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.256g/mol
Monoisotopic Mass	200.062g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	79.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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