Hydroxygenkwanin

CAT: 0127-BUP04444-05Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-BUP04444-05Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

20243-59-8

Synonyms

Luteolin 7-methylether, 7-O-Methylluteolin

Purity

=98%

Smiles

COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1

Chemical Information

Luteolin 7-methyl ether

Luteolin 7-methyl ether is an ether and a member of flavonoids. It is a conjugate acid of a luteolin-5-olate 7-methyl ether.

CAS Number	20243-59-8
PubChem CID	5318214
IUPAC Name	2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Molecular Formula	C16H12O6
Molecular Weight	300.26
XLogP	1.7
Topological Polar Surface Area	96.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	22
Formal Charge	0
Complexity	462

SMILES

COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O

InChI

InChI=1S/C16H12O6/c1-21-9-5-12(19)16-13(20)7-14(22-15(16)6-9)8-2-3-10(17)11(18)4-8/h2-7,17-19H,1H3

InChIKey

RRRSSAVLTCVNIQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20243-59-8

CID: 5318214

Formula: C16H12O6

MW: 300.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	300.26
XLogP3	1.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	300.06338810
Monoisotopic Mass	300.06338810
Topological Polar Surface Area	96.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	462
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes