o-tolualdehyde (Q26828655)

2-Methylbenzaldehyde (English)

5 October 2016

chemical formula

C₈H₈O

1 reference

2-Methylbenzaldehyde (English)

18 November 2016

canonical SMILES

CC1=CC=CC=C1C=O

1 reference

2-Methylbenzaldehyde (English)

18 November 2016

melting point

−35.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

1 reference

1 reference

Carvone and limonene in caraway fruits (Carum carvi L.) analyzed by supercritical carbon dioxide extraction-gas chromatography

Cichorium endivia

1 reference

Neutral volatiles from blended endive (Cichorium endivia, L.)

Gossypium hirsutum

1 reference

Survey of the volatile constituents of cotton lint and waste with regard to byssinosis

Artemisia minor

1 reference

Chemical constituents from the aerial parts of Artemisia minor.

Mangifera indica

1 reference

Volatile components from mango (Mangifera indica L.) cultivars

Nicotiana tabacum

1 reference

A Chemical Study of Burley Tobacco Flavour (Nicotiana tabacum L.). I. Volatile to medium-volatile constituents (b.p. ≦ 84°/0.001 Torr

Cascabela thevetia

1 reference

Volatiles from Flowers of Thevetia peruviana (Pers.) K. Schum. and Allamanda cathartics Linn. (Apocynaceae)

Thevetia peruviana

1 reference

Volatiles from Flowers of Thevetia peruviana (Pers.) K. Schum. and Allamanda cathartics Linn. (Apocynaceae)

Allamanda cathartica

1 reference

Volatiles from Flowers of Thevetia peruviana (Pers.) K. Schum. and Allamanda cathartics Linn. (Apocynaceae)

1 reference

A review of the volatiles from the healthy human body

Identifiers

InChI

InChI=1S/C8H8O/c1-7-4-2-3-5-8(7)6-9/h2-6H,1H3

1 reference

2-Methylbenzaldehyde (English)

18 November 2016

2 references

2-Methylbenzaldehyde (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

529-20-4

2 references

Global Substance Registration System

O-tolualdehyde (English)

18 November 2016

https://commonchemistry.cas.org/detail?cas_rn=529-20-4

9 April 2021

1 reference

o-Tolualdehyde (English)

18 November 2016

2 references

2-Methylbenzaldehyde (English)

18 November 2016

Reaxys registry number

605841

1 reference

o-tolualdehyde (English)

5 October 2016

Gmelin number

3304

0 references

ChEBI ID

27434

mapping relation type

2 references

CHEMBL1487138 (English)

18 November 2016

International Chemical Identifier

InChI

InChI=1S/C8H8O/c1-7-4-2-3-5-8(7)6-9/h2-6H,1H3

1 reference

CHEMBL1487138 (English)

18 November 2016

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP000174

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008702

0 references

SPLASH

splash10-00r6-9700000000-72d2bc27d082e353fdb5

0 references

NMRShiftDB structure ID

10024887

1 reference

Hazardous Substances Data Bank

0 references

0 references

1 reference

28 October 2019

2-METHYLBENZALDEHYDE (English)

10 May 2021

2 references

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

DSSTOX compound identifier

0 references

0 references

1 reference

Global Substance Registration System

O-tolualdehyde (English)

ECHA Substance Infocard ID

18 November 2016

100.007.685

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.007.685

27 December 2018

Human Metabolome Database ID

2-tolualdehyde (English)

quotation

CAS no.: 529-20-4 (English)

FL number

05.026

1 reference

quotation

CAS no.: 529-20-4 (English)

23 January 2021

05.026

1 reference

28 December 2019

O-TOLUALDEHYDE (English)

quotation

CAS no.: 529-20-4 (English)

UM-BBD compound ID

c0250

0 references

HMDB0029636

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00062074

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

O-tolualdehyde (English)

18 November 2016