AG00II7F

944804-80-2 | TERT-BUTYL (5-BROMO-4-CYANOTHIAZOL-2-YL)CARBAMATE

AG00II7F

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	944804-80-2
Catalog Number	AG00II7F(AGN-PC-0WD41K)
Chemical Name	TERT-BUTYL (5-BROMO-4-CYANOTHIAZOL-2-YL)CARBAMATE
IUPAC Name	tert-butyl N-(5-bromo-4-cyano-1,3-thiazol-2-yl)carbamate
InChI	InChI=1S/C9H10BrN3O2S/c1-9(2,3)15-8(14)13-7-12-5(4-11)6(10)16-7/h1-3H3,(H,12,13,14)
InChI Key	OLBIHOOXHIFIHC-UHFFFAOYSA-N
MDL Number	MFCD11111849
Molecular Formula	C9H10BrN3O2S
Molecular Weight	304.1636
SMILES	N#CC1=C(Br)SC(NC(OC(C)(C)C)=O)=N1
Synonyms	944804-80-2, TERT-BUTYL (5-BROMO-4-CYANOTHIAZOL-2-YL)CARBAMATE, N-Boc-2-Amino-5-bromothiazole-4-carbonitrile, tert-butyl 5-bromo-4-cyanothiazol-2-ylcarbamate, SCHEMBL4291782, DTXSID50668694, OLBIHOOXHIFIHC-UHFFFAOYSA-N, MFCD11111849, ZINC39123760, AKOS022175193, FCH1628044, AJ-98624, AK-25199, AS-41628, DA-00491, AX8280120, FT-0702240, ST24049551, tert-Butyl (5-bromo-4-cyano-1,3-thiazol-2-yl)carbamate, 2-Methyl-2-propanyl (5-bromo-4-cyano-1,3-thiazol-2-yl)carbamate, Carbamic acid, N-(5-bromo-4-cyano-2-thiazolyl)-, 1,1-dimethylethyl ester,

Complexity	323
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	302.968g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	304.162g/mol
Monoisotopic Mass	302.968g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	103A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number