AG003HQP

38695-60-2 | 2-Methylsulfonylthiophene

AG003HQP

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CAS Number	38695-60-2
Catalog Number	AG003HQP(AGN-PC-0JV8LB)
Chemical Name	2-Methylsulfonylthiophene
IUPAC Name	2-methylsulfonylthiophene
InChI	InChI=1S/C5H6O2S2/c1-9(6,7)5-3-2-4-8-5/h2-4H,1H3
InChI Key	BNYLGFINMVZZGA-UHFFFAOYSA-N
MDL Number	MFCD00052826
Molecular Formula	C5H6O2S2
Molecular Weight	162.2299
SMILES	O=S(C1=CC=CS1)(C)=O
Synonyms	2-methylsulfonylthiophene, 38695-60-2, 2-(methylsulfonyl)thiophene, 2-methanesulfonylthiophene, 2-Methylsulfony thiophene, MFCD00052826, methyl 2-thienyl sulfone, 2-Methanesulfonyl-thiophene, methylsulfonylthiophene, ACMC-1AGOZ, 2-thienyl methyl sulfone, AC1Q6UVE, Maybridge3_003330, 2-Methylsulfonyl Thiophene, methyl thien-2-yl sulfone, Methyl(2-thienyl) sulfone, AC1LE85Q, 2-(Methanesulfonyl)thiophene, SCHEMBL229283, Thiophene,2-(methylsulfonyl)-, CTK4I0341, ZINC95664, DTXSID00351721, BNYLGFINMVZZGA-UHFFFAOYSA-N, HMS1440H08, SBB087640, AKOS006229560, MCULE-7293917464, PB14102, VT20138, IDI1_014717, 2-(Methylsulfonyl)thiophene, AldrichCPR, AC-18794, AS-50379, ZB003347, TC-170402, CS-0053912, FT-0639492, ST50407210, Q-1088, A824237, AI-942/25034080, I14-63173, AR-1J4893, CID707933, ZINC00095664, 38937-66-5,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.981g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.221g/mol
Monoisotopic Mass	161.981g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	70.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319-H302
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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