5,7-Naringenin dimethyl ether

CAT: 0127-BUP24043-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP24043-01Size:1 mg

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CAS Number

72704-06-4

Purity

≥95%

Smiles

O (C) C1=C2C (O[C@@H] (CC2=O) C3=CC=C (O) C=C3) =CC (OC) =C1

Chemical Information

5,7-Naringenin dimethyl ether

(2S)-2-(4-hydroxyphenyl)-5,7-dimethoxy-2,3-dihydrochromen-4-one has been reported in Abies nephrolepis and Viscum album with data available.

CAS Number	72704-06-4
PubChem CID	40484437
IUPAC Name	(2S)-2-(4-hydroxyphenyl)-5,7-dimethoxy-2,3-dihydrochromen-4-one
Molecular Formula	C17H16O5
Molecular Weight	300.30
XLogP	2.5
Topological Polar Surface Area	65
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	22
Formal Charge	0
Complexity	391

SMILES

COC1=CC2=C(C(=O)C[C@H](O2)C3=CC=C(C=C3)O)C(=C1)OC

InChI

InChI=1S/C17H16O5/c1-20-12-7-15(21-2)17-13(19)9-14(22-16(17)8-12)10-3-5-11(18)6-4-10/h3-8,14,18H,9H2,1-2H3/t14-/m0/s1

InChIKey

REBBZOCNEVVAPX-AWEZNQCLSA-N

Chemical Structure

2D Structure

CAS: 72704-06-4

CID: 40484437

Formula: C17H16O5

MW: 300.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	300.30
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	300.09977361
Monoisotopic Mass	300.09977361
Topological Polar Surface Area	65 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	391
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BUP24084-01	Naringenin 4′,7-dimethyl ether
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BUP00252-01	Kaempferol-7,4'-dimethyl ether
OR51882	Dimethyl ether
OR1010118-01	2,5-Furandimethanol Dimethyl Ether
BUP24170-01	Naringenin 7,4'-diacetate
BUP05226-01	Olivetol Dimethyl Ether
OR1040847-01	Tetrabromobisphenol A-dimethyl ether
BUP00009-01	Pinoresinol dimethyl ether

Catalog	Name
TN8753-01	5,7-Naringenin dimethyl ether
EBA42496-01	Naringenin 4',7-dimethyl ether
TN11274-01	Naringenin 4′,7-dimethyl ether
XC161692-01	Cupressuflavone-7,7”-dimethyl ether
XA161644-01	Agathisflavone-7,7”-dimethyl ether
sc-205133	5-Chlororesorcinol dimethyl ether
GTR19182398	5-Acetoxymatairesinol dimethyl ether
TRC-P266995-1G	5-Pentadecylresorcinol Dimethyl Ether
FO65376	Orobol 7,3'-dimethyl ether
TN2898-01	Kaempferol-7,4'-dimethyl ether