AG003N7A

42059-78-9 | 6-ETHYL-3-FORMYLCHROMONE

AG003N7A

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CAS Number	42059-78-9
Catalog Number	AG003N7A(AGN-PC-0WBOFQ)
Chemical Name	6-ETHYL-3-FORMYLCHROMONE
IUPAC Name	6-ethyl-4-oxochromene-3-carbaldehyde
InChI	InChI=1S/C12H10O3/c1-2-8-3-4-11-10(5-8)12(14)9(6-13)7-15-11/h3-7H,2H2,1H3
InChI Key	XCKTXKYXKJJGBA-UHFFFAOYSA-N
MDL Number	MFCD00192155
Molecular Formula	C12H10O3
Molecular Weight	202.2060
SMILES	CCC1=CC2=C(OC=C(C2=O)C=O)C=C1
Synonyms	6-Ethyl-3-formylchromone, 42059-78-9, 6-ethyl-4-oxo-4H-chromene-3-carbaldehyde, XCKTXKYXKJJGBA-UHFFFAOYSA-N, 6-ethyl-4-oxochromene-3-carbaldehyde, EN300-22561, ACMC-1AMBP, AC1MBZ2M, 6-ethyl-3-formyl chromone, AC1Q2U1Y, SCHEMBL1997471, 6-Ethylchromone-3-carboxaldehyde, CTK4I5645, DTXSID10374522, 6-Ethyl-3-formylchromone, 98%, ZINC2557019, 5985AH, MFCD00192155, SBB042786, STL191076, AKOS000268942, MCULE-8231226880, ACM42059789, UPCMLD0ENAT5522482:001, ST50817614, 6-ethyl-4-oxo-1-benzopyran-3-carboxaldehyde, 4-Oxo-6-ethyl-4H-1-benzopyran-3-carbaldehyde, A-7804, 6-ethyl-4-oxidanylidene-chromene-3-carbaldehyde, 6-Ethyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde, 4H-1-Benzopyran-3-carboxaldehyde,6-ethyl-4-oxo-, A825740, I14-51273, C12H10O3, ZINC02557019, CID2758849,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.063g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	202.209g/mol
Monoisotopic Mass	202.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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