AG00EDML

59303-13-8 | 2-Methyl-5-propionylthiophene

AG00EDML

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CAS Number	59303-13-8
Catalog Number	AG00EDML(AGN-PC-0JT8FH)
Chemical Name	2-Methyl-5-propionylthiophene
IUPAC Name	1-(5-methylthiophen-2-yl)propan-1-one
InChI	InChI=1S/C8H10OS/c1-3-7(9)8-5-4-6(2)10-8/h4-5H,3H2,1-2H3
InChI Key	ROPOMQPSWIOWSN-UHFFFAOYSA-N
MDL Number	MFCD00053143
Molecular Formula	C8H10OS
Molecular Weight	154.2294
SMILES	CCC(C1=CC=C(C)S1)=O
Synonyms	2-Methyl-5-propionylthiophene, 59303-13-8, 1-(5-methylthiophen-2-yl)propan-1-one, 1-(5-methylthien-2-yl)propan-1-one, 1-(5-Methyl-2-thienyl)-1-propanone, 1-(5-Methyl-2-thienyl)propan-1-one, 1-Propanone, 1-(5-methyl-2-thienyl)-, Thiophene, 2-methyl-5-propionyl, 1-(2-Methyl-5-thienyI)-1-propanone, 1-Propanone,1-(5-methyl-2-thienyl)-, AC1LBCOW, AC1Q5G4L, 2-Methyl-5-propanoylthiophene, SCHEMBL4140001, CTK5A9750, DTXSID40342279, ROPOMQPSWIOWSN-UHFFFAOYSA-N, ALBB-002874, ZINC2169346, 6348AE, BBL016562, MFCD00053143, STK424538, AKOS000158645, MCULE-7960075852, 1-(5-Methyl-2-thienyl)-1-propanone #, DA-18590, TR-052914, FT-0707291, ST50928050, W-6388, 1-(5-Methyl-2-thienyl)propan-1-one, AldrichCPR, C8H10OS, AR-1E3765, CID580407, 59748-19-5,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.045g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.227g/mol
Monoisotopic Mass	154.045g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302
Precuationary statements	P280-P305+P351+P338
Siginal words

Certificate of Analysis

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