(E) -Cardamonin

CAT: 0127-BUP11154-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP11154-04Size:100 mg

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CAS Number

19309-14-9

Synonyms

Alpinetin chalcone, Cardamomin, Cardamonin, (E) -Cardamoni

Purity

=98%

Smiles

C(/C=C/C1=CC=CC=C1)(=O)C2=C(OC)C=C(O)C=C2O

Chemical Information

Cardamonin

Cardamonin is a member of chalcones.

CAS Number	19309-14-9
PubChem CID	641785
IUPAC Name	(E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one
Molecular Formula	C16H14O4
Molecular Weight	270.28
XLogP	3.5
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	20
Formal Charge	0
Complexity	346

SMILES

COC1=CC(=CC(=C1C(=O)/C=C/C2=CC=CC=C2)O)O

InChI

InChI=1S/C16H14O4/c1-20-15-10-12(17)9-14(19)16(15)13(18)8-7-11-5-3-2-4-6-11/h2-10,17,19H,1H3/b8-7+

InChIKey

NYSZJNUIVUBQMM-BQYQJAHWSA-N

Chemical Structure

2D Structure

CAS: 19309-14-9

CID: 641785

Formula: C16H14O4

MW: 270.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	270.28
XLogP3	3.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	270.08920892
Monoisotopic Mass	270.08920892
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	346
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BUP05834-01	Cardamonin
BUP12726-01	(E, E) -RAMB4
OR1030541-01	(E, E) -2,4-Hexadienal
OR1079737	(+) -Benzylmethylphenylsilylacetic Acid [for e.e. Determination by NMR]
BUP23182	Isogarciniaxanthone E
BUP23101	Garciniaxanthone E
BUP21478-01	Yadanzioside E
BUP20825-01	Hederacolchiside E
BUP00814-01	Clausine E
BUP07283-01	Bruceine E

Catalog	Name
FC66017-01	Cardamonin
GTR19162923-01	Cardamonin?