AG001DVH

14630-09-2 | Thieno[3,4-b]thiophene-2-carboxylic acid, methyl ester

AG001DVH

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CAS Number	14630-09-2
Catalog Number	AG001DVH(AGN-PC-025A7T)
Chemical Name	Thieno[3,4-b]thiophene-2-carboxylic acid, methyl ester
IUPAC Name	methyl thieno[2,3-c]thiophene-2-carboxylate
InChI	InChI=1S/C8H6O2S2/c1-10-8(9)6-2-5-3-11-4-7(5)12-6/h2-4H,1H3
InChI Key	SZQBTRYNPBOBGC-UHFFFAOYSA-N
MDL Number	MFCD28015646
Molecular Formula	C8H6O2S2
Molecular Weight	198.2620
SMILES	O=C(C1=CC2=CSC=C2S1)OC
Synonyms	Methyl thieno[3,4-b]thiophene-2-carboxylate, 14630-09-2, THIENO[3,4-B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER, SCHEMBL1658504, SZQBTRYNPBOBGC-UHFFFAOYSA-N, KS-00000SG1, MFCD28015646, ZINC98181517, AKOS024262345, DS-9134, AK158061, AJ-142623, FT-0757150, methyl thieno[2,3-c]thiophene-2-carboxylate, ST24048092, Thieno[3,4-b]thiophene-2-carboxylic acid, methyl ester,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.981g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.254g/mol
Monoisotopic Mass	197.981g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	82.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

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