AG00I48G

21835-01-8 | 2-Cyclopenten-1-one, 3-ethyl-2-hydroxy-

AG00I48G

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CAS Number	21835-01-8
Catalog Number	AG00I48G(AGN-PC-0JL56F)
Chemical Name	2-Cyclopenten-1-one, 3-ethyl-2-hydroxy-
EC Number	244-606-5
FEMA Number	3152
IUPAC Name	3-ethyl-2-hydroxycyclopent-2-en-1-one
InChI	InChI=1S/C7H10O2/c1-2-5-3-4-6(8)7(5)9/h9H,2-4H2,1H3
InChI Key	JHWFWLUAUPZUCP-UHFFFAOYSA-N
MDL Number	MFCD00012391
Molecular Formula	C7H10O2
Molecular Weight	126.1531
SMILES	OC1=C(CC)CCC1=O
UNII	XH8EA788C9
Synonyms	3-ethyl-2-hydroxy-2-cyclopenten-1-one, 21835-01-8, 3-ETHYL-2-HYDROXY-2-CYCLOPENTEN-1-ONE, 3-Ethyl-2-hydroxycyclopent-2-enone, 2-Cyclopenten-1-one, 3-ethyl-2-hydroxy-, 3-Ethyl-2-hydroxycyclopent-2-en-1-one, 2-Hydroxy-3-ethyl-2-cyclopenten-1-one, FEMA No. 3152, 3-Ethyl-2-cyclopenten-2-ol-1-one, UNII-XH8EA788C9, 2-Hydroxy-3-ethyl-2-cyclopentene-1-one, XH8EA788C9, JHWFWLUAUPZUCP-UHFFFAOYSA-N, 3-Ethyl-2-hydroxy-2-cyclopenten-1-one solution, 3-Ethyl-2-hydroxy-2-cyclopentenone, EINECS 244-606-5, Enol-3-Ethyl-1,2-cyclopentanedione, 2-Cyclopenten-1-one, 2-hydroxy-3-ethyl, coffee pentenolone, ethyl cyclopentenolone, ACMC-209fom, AC1L1XPM, AC1Q2T59, SCHEMBL1171891, DTXSID0044232, CTK1A2774, KS-000015CY, ANW-24596, MFCD00012391, ZINC25695693, AKOS009031448, AM84771, LS-2729, NE10702, AJ-82035, Ethylcyclopentenolone, natural, 97%, FG, O301, DB-045709, RT-004630, E0792, FT-0638153, ST24028506, EN300-34056, I14-7187, J-014311, 3-Ethyl-2-hydroxy-2-cyclopenten-1-one solution, 50 wt. % in propylene glycol, 2-phenyl-5-methyl-2-hexenal, 5-Methyl-2-phenyl-2-hexenal, C7H10O2, CID62752, 3-ETHYL-1,2-CYCLOPENTANEDIONE,

Complexity	168
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.068g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.155g/mol
Monoisotopic Mass	126.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P280-P333+P313
UN Code

Certificate of Analysis

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