AG001DPT

146137-92-0 | Benzo[b]thiophene-2-carboxylic acid, 5-(trifluoromethyl)-, methyl ester

AG001DPT

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	146137-92-0
Catalog Number	AG001DPT(AGN-PC-0K5S0O)
Chemical Name	Benzo[b]thiophene-2-carboxylic acid, 5-(trifluoromethyl)-, methyl ester
IUPAC Name	methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate
InChI	InChI=1S/C11H7F3O2S/c1-16-10(15)9-5-6-4-7(11(12,13)14)2-3-8(6)17-9/h2-5H,1H3
InChI Key	JWHOGTDVUZFYNO-UHFFFAOYSA-N
MDL Number	MFCD03012932
Molecular Formula	C11H7F3O2S
Molecular Weight	260.2323
SMILES	O=C(C1=CC2=CC(C(F)(F)F)=CC=C2S1)OC
Synonyms	146137-92-0, methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate, Methyl 5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate, 5-Trifluoromethyl-benzo[b]thiophene-2-carboxylic acid methyl ester, Benzo[b]thiophene-2-carboxylicacid, 5-(trifluoromethyl)-, methyl ester, JWHOGTDVUZFYNO-UHFFFAOYSA-N, ACMC-1C1VE, AC1LRV44, SCHEMBL2895393, CTK4C4824, DTXSID10363133, KS-00001X0P, ZINC1390455, 4441AD, MFCD03012932, SBB102288, AKOS005070519, MCULE-7783196700, NE62832, RP14711, RTR-005785, AJ-25498, ZB016938, TR-005785, FT-0680401, 4T-1505, A808460, AN-584/43484535, J-522422, I01-14801, Methyl5-trifluoromethyl-1-benzothiophene-2-carboxylate, Methyl 5-trifluoromethyl-1-benzothiophene-2-carboxylate, methyl 5-trifluoromethylbenzo[b]thiophene-2-carboxylate, 2-(Methoxycarbonyl)-5-(trifluoromethyl)-1-benzothiophene, 5-(trifluoromethyl)-1-benzothiophene-2-carboxylic acid methyl ester, Benzo[b]thiophene-2-carboxylic acid, 5-(trifluoromethyl)-, methyl ester, C11H7F3O2S, ZINC01390455, ACN-045153, CID1477956, 5-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLICACIDMETHYLESTER,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	260.012g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	260.23g/mol
Monoisotopic Mass	260.012g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	54.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number