6-Methoxy-2,2-dimethylchroman-4-one - CAS 13229-59-9

Catalog:	BB007572
Product Name:	6-Methoxy-2,2-dimethylchroman-4-one
CAS:	13229-59-9
Synonyms:	6-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one; 6-methoxy-2,2-dimethyl-3H-chromen-4-one

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	6-methoxy-2,2-dimethyl-3H-chromen-4-one
Description:	6-Methoxy-2,2-dimethylchroman-4-one (CAS# 13229-59-9) is a useful research chemical.
Molecular Weight:	206.24
Molecular Formula:	C12H14O3
Canonical SMILES:	CC1(CC(=O)C2=C(O1)C=CC(=C2)OC)C
InChI:	InChI=1S/C12H14O3/c1-12(2)7-10(13)9-6-8(14-3)4-5-11(9)15-12/h4-6H,7H2,1-3H3
InChI Key:	ZCZUDOBLRMXOGV-UHFFFAOYSA-N
Melting Point:	75 °C
Solubility:	247.5 mg/L at 25 °C (est)
Appearance:	Solid
LogP:	2.43900

Publication Number	Title	Priority Date
EP-2739614-A1	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20110805
EP-2739614-B1	AMINOCHROMANEs, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY	20110805
JP-2014521682-A	Aminochroman, aminothiochroman and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20110805
MX-2014001457-A	DERIVATIVES OF AMINOCROMANO, AMINOTIOCROMANO AND AMINO-1,2,3,4-TETRAHYDROQUINOLINE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY.	20110805
US-2013035323-A1	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20110805

PMID	Publication Date	Title	Journal
22816304	20120601	Secondary metabolite production by the basidiomycete, Lentinus strigellus, under different culture conditions	Natural product communications

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

Complexity:	260
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	206.094294304
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	206.094294304
Rotatable Bond Count:	1
Topological Polar Surface Area:	35.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2