AG0032UT

58861-48-6 | 2-(4-FLUOROPHENYL)THIOPHENE

AG0032UT

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CAS Number	58861-48-6
Catalog Number	AG0032UT(AGN-PC-03HC24)
Chemical Name	2-(4-FLUOROPHENYL)THIOPHENE
EC Number	611-756-1
IUPAC Name	2-(4-fluorophenyl)thiophene
InChI	InChI=1S/C10H7FS/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H
InChI Key	PURJRGMZIKXDMW-UHFFFAOYSA-N
MDL Number	MFCD06802535
Molecular Formula	C10H7FS
Molecular Weight	178.2260
SMILES	FC1=CC=C(C=C1)C=1SC=CC1
Synonyms	2-(4-fluorophenyl)thiophene, 58861-48-6, 2-(4-Fluoro-phenyl)-thiophene, 2-(4-fluorophenyl)-thiophene, Thiophene, 2-(4-fluorophenyl)-, 4-fluorophenylthiphene, Canagliflozin Intermediate I, SCHEMBL154088, THI100, CTK3J7779, KS-00000OQI, DTXSID60619591, PURJRGMZIKXDMW-UHFFFAOYSA-N, Canagliflozin Related Impurity 14, BCP22383, CS-M2131, ZINC8764139, ANW-48594, BBL103247, GEO-03158, MFCD06802535, STL557057, AKOS004118865, AN-2615, LS11696, PB10393, RP23965, TRA0016606, VT20066, AC-29154, AJ-59238, AT-24123, BC665967, BR-49954, DS-15181, SY042584, DB-013907, RT-003999, TL8003763, 4CH-010444, BB 0223633, F0724, FT-0657107, ST24021780, W7182, MFCD06802535 (95%), S-5635, 861F486, A832044, I09-1374, J-505998, 2- thiophene, Canagliflozin Impurity B, C10H7FS, ACN-028638, CS-T-54832, EC 611-756-1, 58861-49-7,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.025g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.224g/mol
Monoisotopic Mass	178.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	28.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number