AG0033DT

765-69-5 | 2-Methyl-1,3-cyclopentanedione

AG0033DT

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CAS Number	765-69-5
Catalog Number	AG0033DT(AGN-PC-0JKAXE)
Chemical Name	2-Methyl-1,3-cyclopentanedione
EC Number	212-153-2
IUPAC Name	2-methylcyclopentane-1,3-dione
InChI	InChI=1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3
InChI Key	HXZILEQYFQYQCE-UHFFFAOYSA-N
MDL Number	MFCD00001406
Molecular Formula	C6H8O2
Molecular Weight	112.1265
NSC Number	54458
SMILES	CC1C(CCC1=O)=O
UNII	C9LG5VP01C
Synonyms	2-METHYL-1,3-CYCLOPENTANEDIONE, 2-Methylcyclopentane-1,3-dione, 765-69-5, 1,3-Cyclopentanedione, 2-methyl-, 2-Methyl-1,3-cyclopentadione, MFCD00001406, 2-Methyl-cyclopentane-1,3-dione, UNII-C9LG5VP01C, C9LG5VP01C, HXZILEQYFQYQCE-UHFFFAOYSA-N, 2-Methyl-1,3-cyclopentanedione, 98%, Methylcycle-D, NSC54458, EINECS 212-153-2, PubChem2206, AC1Q2QFE, ACMC-209p4n, EC 212-153-2, AC1L20TT, Benzil-related compound, 46, ghl.PD_Mitscher_leg0.841, KSC495K7L, SCHEMBL661313, 2-methyl-1,3-cyclopentandione, CHEMBL363186, 2-Methyl-1,3-dioxocyclopentane, BDBM22768, CTK3J5575, DTXSID30227309, 2-Methyl cyclopentane-1,3-dione, ZINC331660, EBD10349, KS-00000N4W, AN-149, ANW-36837, NSC-54458, SBB060744, STK499478, AKOS000370047, CS-W013660, MCULE-4418458735, PS-3179, RP19054, TRA0026765, 2-Methyl-1,3-cyclopentanedione, 99%, 424823-07-4, AJ-19445, AK-50538, BR-50538, CJ-02797, SC-62325, SY015623, ZB010574, AB0012872, DB-021316, RT-002601, ST2410145, TL8005239, AM20100124, FT-0613037, M0901, ST51046865, EN300-21600, MFCD00001406 (98%), 765M695, AC-907/25014141, I14-1880, W-104357, Z1202105679, 1, 2-methyl-, 2-Methylcyclopentanedione-1,3, C6H8O2, 1,3-Cyclopentanedione,2-methyl-, C6-H8-O2, CID13005, H067, M-3594, 2-Methyl-1,3-cyclopentanedione, 98% - 25G 25g,

Complexity	122
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	112.052g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	112.128g/mol
Monoisotopic Mass	112.052g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number