(Q222993)

3',4'-Dimethoxyacetophenone (English)

9 October 2016

chemical formula

C₁₀H₁₂O₃

1 reference

3',4'-Dimethoxyacetophenone (English)

20 November 2016

canonical SMILES

CC(=O)C1=CC(=C(C=C1)OC)OC

1 reference

3',4'-Dimethoxyacetophenone (English)

20 November 2016

melting point

49.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Diospyros maritima

1 reference

Chemical constituents from the stems of Diospyros maritima

Iris pallida

1 reference

Études sur les matières végétales volatiles XCIII. Sur les constituants cétoniques secondaires de l'huile essentielle d'iris

Vincetoxicum changqinianum

1 reference

Simultaneous determination of ten bioactive compaounds from the roots of Cynanchum paniculatum by using high performance liquid chromatography coupled-diode array detector

Vincetoxicum mukdenense

1 reference

Simultaneous determination of ten bioactive compaounds from the roots of Cynanchum paniculatum by using high performance liquid chromatography coupled-diode array detector

Identifiers

InChI

InChI=1S/C10H12O3/c1-7(11)8-4-5-9(12-2)10(6-8)13-3/h4-6H,1-3H3

1 reference

3',4'-Dimethoxyacetophenone (English)

IQZLUWLMQNGTIW-UHFFFAOYSA-N

20 November 2016

InChIKey

2 references

3',4'-Dimethoxyacetophenone (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

1131-62-0

2 references

Global Substance Registration System

3,4-dimethoxyphenyl methyl ketone (English)

IQZLUWLMQNGTIW-UHFFFAOYSA-N

20 November 2016

InChIKey

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1131-62-0

1 reference

3,4-Dimethoxyacetophenone (English)

20 November 2016

1 reference

3',4'-Dimethoxyacetophenone (English)

20 November 2016

Reaxys registry number

781213

1 reference

acetoveratrone (English)

9 October 2016

ChEBI ID

86576

mapping relation type

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP008614

acetoveratrone (English)

9 October 2016

1 reference

MassBank accession ID

0 references

SPLASH

splash10-014i-6900000000-fab3be00362e31d8eccf

0 references

DSSTox substance ID

DTXSID4061549

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

0 references

214-468-0

1 reference

Global Substance Registration System

3,4-dimethoxyphenyl methyl ketone (English)

ECHA Substance Infocard ID

20 November 2016

100.013.153

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.013.153

27 December 2018

Human Metabolome Database ID

1-(3,4-dimethoxyphenyl)ethan-1-one (English)

quotation

CAS no.: 1131-62-0 (English)

HMDB0301758

1 reference

based on heuristic

inferred from InChIKey

1 reference

Global Substance Registration System

3,4-dimethoxyphenyl methyl ketone (English)