AG00BDLW

24090-38-8 | 3-(5-Thiophen-2-yl-furan-2-yl)-propionic acid

AG00BDLW

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CAS Number	24090-38-8
Catalog Number	AG00BDLW(AGN-PC-0R01AS)
Chemical Name	3-(5-Thiophen-2-yl-furan-2-yl)-propionic acid
IUPAC Name	3-(5-thiophen-2-ylfuran-2-yl)propanoic acid
InChI	InChI=1S/C11H10O3S/c12-11(13)6-4-8-3-5-9(14-8)10-2-1-7-15-10/h1-3,5,7H,4,6H2,(H,12,13)
InChI Key	ADIPPCCQUCTDJD-UHFFFAOYSA-N
MDL Number	MFCD03269407
Molecular Formula	C11H10O3S
Molecular Weight	222.2603
SMILES	O=C(O)CCC1=CC=C(C2=CC=CS2)O1
Synonyms	24090-38-8, 3-(5-Thiophen-2-yl-furan-2-yl)-propionic acid, 3-(5-(Thiophen-2-yl)furan-2-yl)propanoic acid, 3-(5-thiophen-2-ylfuran-2-yl)propanoic acid, 3-(5-thiophen-2-yl-furan-2-yl)propionic acid, 3-[5-(2-thienyl)-2-furyl]propanoic acid, MLS000112485, SMR000108399, 3-[5-(thiophen-2-yl)furan-2-yl]propanoic acid, 3-(5-(2-thienyl)-2-furyl)propanoic acid, 2-Furanpropanoic acid,5-(2-thienyl)-, AC1LEBKN, 2-furanpropanoic acid, 5-(2-thienyl)-, BAS 03633798, AC1Q5VXT, Cambridge id 6847944, TimTec1_006301, cid_709558, CHEMBL1432336, SCHEMBL18169200, BDBM54722, CTK4F2905, ZINC99261, ADIPPCCQUCTDJD-UHFFFAOYSA-N, HMS1551O09, HMS2495H12, ZX-CM017041, 1740AB, 8124AD, MFCD03269407, SBB027763, STK030285, AKOS000300201, MCULE-1812352676, AJ-11077, CC-12575, ST070888, 3-[5-(2-thienyl)-2-furyl]propionic acid, DB-046344, TR-011148, FT-0638388, MLS000112485-02, 3-(5-thiophen-2-yl-2-furanyl)propanoic acid, Y-0262, C-12413, I04-5819, Propionic acid, 3-(5-thiophen-2-yl-furan-2-yl)-, BRD-K90898105-001-07-2, A2933/0123428, 3-(5-thiophen-2-yl-furan-2-yl)-propionic acid, AldrichCPR, C11H10O3S, C14H16O5, AR-1E1856, CID709558, 7-(4-methoxyphenyl)-4,7-dioxoheptanoic acid, 24090-40-2, 24232-36-8,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.258g/mol
Monoisotopic Mass	222.035g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	78.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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