AG003B68

135-00-2 | Phenyl(thiophen-2-yl)methanone

AG003B68

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CAS Number	135-00-2
Catalog Number	AG003B68(AGN-PC-0JL7PE)
Chemical Name	Phenyl(thiophen-2-yl)methanone
EC Number	205-169-6
IUPAC Name	phenyl(thiophen-2-yl)methanone
InChI	InChI=1S/C11H8OS/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8H
InChI Key	DWYFUJJWTRPARQ-UHFFFAOYSA-N
MDL Number	MFCD00022495
Molecular Formula	C11H8OS
Molecular Weight	188.2456
NSC Number	4502
SMILES	O=C(C1=CC=CC=C1)C2=CC=CS2
Synonyms	2-Benzoylthiophene, 135-00-2, phenyl(thiophen-2-yl)methanone, Phenyl 2-thienyl ketone, Methanone, phenyl-2-thienyl-, Ketone, phenyl 2-thienyl, Phenyl(2-thienyl)methanone, 2-Thienyl phenyl ketone, .alpha.-Benzoylthiophene, NSC-4502, phenyl-thiophen-2-yl-methanone, CHEMBL567059, DWYFUJJWTRPARQ-UHFFFAOYSA-N, MFCD00022495, 2-benzoyl thiophene, EINECS 205-169-6, AI3-11217, AC1Q5EYP, phenyl-2-thienylmethanone, ACMC-1BT4J, ChemDiv2_003411, 2-Benzoylthiophene, 98%, phenyl(thien-2-yl)methanone, KSC497C5D, MLS000682816, ARONIS25091, BIDD:GT0337, Phenyl(2-thienyl)methanone #, SCHEMBL158020, AC1L276N, CTK3J7151, DWYFUJJWTRPARQ-UHFFFAOYSA-, DTXSID30159191, NSC4502, HMS1378L01, HMS2600E06, ZINC160637, KS-000046ZU, ANW-19732, BBL027877, BDBM50300127, SBB032281, STK400202, AKOS000310023, CCG-202927, MCULE-4790732265, VT20104, NCGC00245936-01, AJ-15620, AK-58341, AN-25330, CJ-01935, SMR000312173, SY036770, ZB007412, DB-020554, RT-003573, ST2419785, ST4019631, AM20020418, B0308, FT-0611297, Y3200, MFCD00022495 (97%), A806865, SR-01000597211, J-006630, SR-01000597211-1, I14-11046, A0935/0043787, InChI=1/C11H8OS/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8H, 22044-15-1, Benzoyl thiol, C11H8OS, C11-H8-O-S, CID67262, AR-1H9420, N-{2-[5-(1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N-methylisonicotinamide, 13636-32-3,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.03g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.244g/mol
Monoisotopic Mass	188.03g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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