AG0000RP

1000577-81-0 | Thieno[3,2-c]pyridine-5(4H)-carboxylic acid, 3-bromo-6,7-dihydro-, 1,1-dimethylethyl ester

AG0000RP

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1000577-81-0
Catalog Number	AG0000RP(AGN-PC-0782KB)
Chemical Name	Thieno[3,2-c]pyridine-5(4H)-carboxylic acid, 3-bromo-6,7-dihydro-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 3-bromo-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate
InChI	InChI=1S/C12H16BrNO2S/c1-12(2,3)16-11(15)14-5-4-10-8(6-14)9(13)7-17-10/h7H,4-6H2,1-3H3
InChI Key	OZMHRZWKQLSLQP-UHFFFAOYSA-N
MDL Number	MFCD09878671
Molecular Formula	C12H16BrNO2S
Molecular Weight	318.2299
SMILES	CC(C)(C)OC(=O)N1CCC2=C(C1)C(Br)=CS2
Synonyms	tert-butyl 3-Bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4H)-carboxylate, 1000577-81-0, AK-50793, PubChem17835, SCHEMBL17377231, CTK7G2912, DTXSID90659980, KS-00000I0E, 0072AA, ANW-66389, MFCD09878671, ZINC35269710, AKOS015835724, FCH1627207, AJ-90867, BC004292, DS-15549, AX8162753, DB-058268, ST2407663, TR-039454, 4CH-018474, FT-0718075, tert-butyl 3-bromo-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate, tert-Butyl3-Bromo-6,7-dihydrothieno[3,2-c]pyridine-5(4H)-carboxylate, Thieno[3,2-c]pyridine-5(4H)-carboxylic acid, 3-bromo-6,7-dihydro-, 1,1-dimethylethyl ester, C12H16BrNO2S,

Complexity	305
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	317.009g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.229g/mol
Monoisotopic Mass	317.009g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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