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Chemical Entities of Biological Interest Ontology
Last uploaded:
January 1, 2025
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| Preferred Name | benzaldehyde | |
| Synonyms |
Benzenecarboxaldehyde Benzenemethylal Benzenecarbonal Synthetic oil of bitter almond Benzene carboxaldehyde Artificial almond oil Phenylformaldehyde Benzene carbaldehyde Benzoic acid aldehyde Benzoic aldehyde Phenylmethanal Benzylaldehyde Ethereal oil of bitter almonds Benzanoaldehyde benzaldehyde Benzaldehyde |
|
| Definitions |
An arenecarbaldehyde that consists of benzene bearing a single formyl substituent; the simplest aromatic aldehyde and parent of the class of benzaldehydes. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_17169 |
|
| charge |
0
|
|
| database_cross_reference |
Wikipedia:Benzaldehyde PMID:12692643 KEGG:C00193 PMID:23263855 PMID:11943806 UM-BBD_compID:c0279 Reaxys:471223 PMID:21035797 PMID:18348134 PMID:16248550 PMID:16557466 PMID:15658857 PMID:1388821 PMID:20878540 PMID:15087594 PDBeChem:HBX PMID:16508147 PMID:12746108 KEGG:C00261 PMID:20733068 CAS:100-52-7 PMID:12738275 PMID:21773601 KEGG:D02314 MetaCyc:BENZALDEHYDE HMDB:HMDB0006115 PMID:21538605 PMID:21828928
|
|
| definition |
An arenecarbaldehyde that consists of benzene bearing a single formyl substituent; the simplest aromatic aldehyde and parent of the class of benzaldehydes.
|
|
| formula |
C7H6O
|
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_76924 http://purl.obolibrary.org/obo/CHEBI_48318 http://purl.obolibrary.org/obo/CHEBI_77118 http://purl.obolibrary.org/obo/CHEBI_62873 |
|
| has_alternative_id |
CHEBI:3019 CHEBI:13875 CHEBI:22697
|
|
| has_exact_synonym |
benzaldehyde Benzaldehyde
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
Benzenecarboxaldehyde Benzenemethylal Benzenecarbonal Synthetic oil of bitter almond Benzene carboxaldehyde Artificial almond oil Phenylformaldehyde Benzene carbaldehyde Benzoic acid aldehyde Benzoic aldehyde Phenylmethanal Benzylaldehyde Ethereal oil of bitter almonds Benzanoaldehyde
|
|
| id |
CHEBI:17169
|
|
| in_subset | ||
| inchi |
InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H
|
|
| inchikey |
HUMNYLRZRPPJDN-UHFFFAOYSA-N
|
|
| label |
benzaldehyde
|
|
| mass |
106.12190
|
|
| monoisotopicmass |
106.04186
|
|
| notation |
CHEBI:17169
|
|
| prefLabel |
benzaldehyde
|
|
| smiles |
O=Cc1ccccc1
|
|
| treeView | ||
| subClassOf |
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