AG0012DI

13679-75-9 | 1-(Thiophen-2-yl)propan-1-one

AG0012DI

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CAS Number	13679-75-9
Catalog Number	AG0012DI(AGN-PC-0WALVA)
Chemical Name	1-(Thiophen-2-yl)propan-1-one
EC Number	237-182-8
IUPAC Name	1-thiophen-2-ylpropan-1-one
InChI	InChI=1S/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3
InChI Key	MFPZQZZWAMAHOY-UHFFFAOYSA-N
MDL Number	MFCD00005446
Molecular Formula	C7H8OS
Molecular Weight	140.2028
NSC Number	76041
SMILES	CCC(=O)C1=CC=CS1
UNII	NY658TVP5M
Synonyms	1-(2-Thienyl)-1-propanone, 13679-75-9, 2-Propionylthiophene, 1-(thiophen-2-yl)propan-1-one, 1-(2-Thienyl)propan-1-one, Ethyl 2-Thienyl Ketone, 2-Propanoylthiophene, 1-Propanone, 1-(2-thienyl)-, UNII-NY658TVP5M, ethyl thienyl ketone, 1-thiophen-2-ylpropan-1-one, ETHYL-2-THIENYL KETONE, Ethyl-2-thienylketone, Thiophene, 2-propionyl, 1-(2-thienyl)propanone, MFCD00005446, 2-(1-propionyl)thiophene, 1-thien-2-ylpropan-1-one, NY658TVP5M, 1-thiophene-2-yl-propan-1-one, MFPZQZZWAMAHOY-UHFFFAOYSA-N, Propiothienone, 2-propionylthiophen, NSC76041, 2-propionyithiophene, EINECS 237-182-8, NSC 76041, 2-(propionyl)thiophene, PubChem12618, akos b000292, 1-2-thienyl-1-propanone, ACMC-209c9y, AC1L1AL9, 1-(2-thienyl)-1-propanon, 1 -(Thienyl)-1 -propanone, BIDD:GT0341, 1-thiophen-2-yl-1-propanone, SCHEMBL1232758, 1-thiophen-2-yl-propan-1-one, Jsp002219, CTK3J7155, KS-00000VFD, MFPZQZZWAMAHOY-UHFFFAOYSA-, DTXSID70159933, ZINC159604, ALBB-002872, 1-(2-Thienyl)-1-propanone, 9CI, ANW-20180, BBL037420, GEO-02301, NSC-76041, SBB028613, STK398288, 1-(2-Thienyl)-1-propanone, 98%, AKOS000120703, MCULE-6810531901, RTR-004913, VZ20881, AC-15717, AJ-15506, AN-18476, SC-77380, ZB007262, DB-042356, ST2415123, TR-004913, FT-0605572, P1097, ST45255795, 1-(2-Thienyl)-1-propanone, >=97%, FG, W-6180, A807136, W-108249, I14-31029, F0001-0465, InChI=1/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3, C7H8OS, 1- -1-PROPANONE, C7-H8-O-S, CID26179, 1-(2-Thienyl)-1-propanone, 98% - 25G 25g, 43039-99-2,

Complexity	112
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.03g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	140.2g/mol
Monoisotopic Mass	140.03g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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