4-Methyl-2H-Pyran-2,6(3H)-dione - CAS 67116-19-2

Catalog:	BB054221
Product Name:	4-Methyl-2H-Pyran-2,6(3H)-dione
CAS:	67116-19-2
Synonyms:	2H-Pyran-2,6(3H)-dione, 4-methyl-; NSC-176171; 3-Methylglutaconic anhydride; 6-Hydroxy-4-methyl-2-pyrone; Glutaconic anhydride, 3-methyl-; 1,2-Pyrone, 6-hydroxy-4-methyl-; 2H-Pyran-2-one, 6-hydroxy-4-methyl-; 4-Methyl-3,6-dihydro-2H-pyran-2,6-dione

Technical Data

Computed Properties

IUPAC Name:	4-methyl-3H-pyran-2,6-dione
Molecular Weight:	126.11
Molecular Formula:	C6H6O3
Canonical SMILES:	CC1=CC(=O)OC(=O)C1
InChI:	InChI=1S/C6H6O3/c1-4-2-5(7)9-6(8)3-4/h2H,3H2,1H3
InChI Key:	RUMVLFICHAFVGF-UHFFFAOYSA-N
Boiling Point:	249.3±19.0°C (Predicted)
Melting Point:	86°C
Purity:	≥95%
Density:	1.239±0.06 g/cm3 (Predicted)

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[438616-66-1]
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide

Pyrans

[1496582-11-6]
2,6-Dichloro-4-(tetrahydro-2H-pyran-4-yl)pyridine
[6089-04-9]
Tetrahydro-2-(2-propynyloxy)-2H-pyran
[40191-32-0]
Tetrahydro-2H-pyran-4-carbonyl chloride
[4717-96-8]
4-Methyltetrahydropyran
[7525-64-6]
4-Methyltetrahydropyran-4-ol
[693287-79-5]
1-Boc-2-(4-tetrahydropyranyl)hydrazine

Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	126.031694049
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	126.031694049
Rotatable Bond Count:	0
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0