AG002FBR

19156-50-4 | 3-Thiophenecarboxylic acid, 5-methyl-

AG002FBR

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CAS Number	19156-50-4
Catalog Number	AG002FBR(AGN-PC-0JN2VT)
Chemical Name	3-Thiophenecarboxylic acid, 5-methyl-
IUPAC Name	5-methylthiophene-3-carboxylic acid
InChI	InChI=1S/C6H6O2S/c1-4-2-5(3-9-4)6(7)8/h2-3H,1H3,(H,7,8)
InChI Key	VFORWJLUXKGLAH-UHFFFAOYSA-N
MDL Number	MFCD01680229
Molecular Formula	C6H6O2S
Molecular Weight	142.1756
SMILES	CC1=CC(=CS1)C(O)=O
Synonyms	5-methylthiophene-3-carboxylic acid, 19156-50-4, 3-Thiophenecarboxylic acid, 5-methyl-, 5-Methyl-3-thiophenecarboxylic acid, 5-Methyl-thiophene-3-carboxylic acid, BRN 0002475, 3-Thiophenecarboxylicacid, 5-methyl-, MFCD01680229, AC1L4LWY, AC1Q5TSY, ACMC-209ev2, 3-Carboxy-5-methylthiophene, 5-18-06-00217 (Beilstein Handbook Reference), SCHEMBL131281, CTK0H9345, DTXSID90172684, VFORWJLUXKGLAH-UHFFFAOYSA-N, HMS1698A14, ALBB-000918, KS-00002AG3, ZINC2383077, 2-Methylthiophene-4-carboxylic acid, ANW-23532, BBL016192, SBB009287, STK349060, AKOS000308309, MCULE-5909428849, PB14265, PS-5550, QC-6006, RP01318, TRA0053390, NCGC00340357-01, AJ-34930, BAS 10157245, BL001054, SY014238, AB0040499, DB-065750, LS-153028, ST2412113, TX-010084, BB 0253278, CS-0054889, FT-0678374, ST45171019, Y8110, B-7621, AB01333071-02, MFCD01680229 (97+%), 5-methyl-thiophene-3-carboxylic acid, AldrichCPR, I04-4556, W-206412, 5-methylthiophen-3-amine, C6H6O2S, C6-H6-O2-S, 2-(4-methylpiperazin-1-yl)ethanol, AR-1G9064, CID209069, 1-(2-Hydroxyethyl)-4-methylpiperazine, (3-METHOXYBUTYL)AMINE HYDROCHLORIDE, A7929, 5-methylthiophene-3-carboxylic acid, 95% - 1G 1g, 5464-12-0, 153137-85-0,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.009g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	142.172g/mol
Monoisotopic Mass	142.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	65.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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