4,4'-DIMETHOXYCHALCONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H16O3
Molecular Weight	268.3071
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 4,4'-DIMETHOXYCHALCONE

Structure Search

SMILES

COC1=CC=C(\C=C\C(=O)C2=CC=C(OC)C=C2)C=C1

InChI

InChIKey=HDXVSZWKIHQDES-LFYBBSHMSA-N

InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+

HIDE SMILES / InChI

Molecular Formula	C17H16O3
Molecular Weight	268.3071
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:03:53 GMT 2025` Edited by `admin` on `Tue Apr 01 20:03:53 GMT 2025`
Record UNII	8KJ379G3P2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-87339

Preferred Name

English

4,4'-DIMETHOXYCHALCONE

Common Name

English

2-PROPEN-1-ONE, 1,3-BIS(4-METHOXYPHENYL)-, (2E)-

Systematic Name

English

TRANS-4,4'-DIMETHOXYCHALCONE

Common Name

English

(E)-4,4'-DIMETHOXYCHALCONE

Common Name

English

2-PROPEN-1-ONE, 1,3-BIS(4-METHOXYPHENYL)-

Systematic Name

English

1,3-BIS(4-METHOXYPHENYL)PROPENONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID001311791

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

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FDA UNII

8KJ379G3P2

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

PRIMARY

NSC

87339

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

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PUBCHEM

5377817

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

PRIMARY

CAS

2373-89-9

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

CAS

41564-67-4

Created by admin on Tue Apr 01 20:03:53 GMT 2025 , Edited by admin on Tue Apr 01 20:03:53 GMT 2025

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