| 2D Structure | |
| CID | 240 |
| Target | ALDH1A1 , Chain B, SARS CORONAVIRUS MAIN PROTEINASE , Cyp2a5 , CYP2A6 |
| IUPAC Name | benzaldehyde |
| InChI | InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H |
| InChI Key | HUMNYLRZRPPJDN-UHFFFAOYSA-N |
| Canonical SMILES | C1=CC=C(C=C1)C=O |
| Isomeric SMILES | C1=CC=C(C=C1)C=O |
| Molecular Formula | C7H6O |
| Molecular Weight | 106.12 |
| synonyms | ['benzaldehyde', '100-52-7', 'Benzoic aldehyde', 'Phenylmethanal', 'Benzenecarboxaldehyde', 'Benzenecarbonal', 'Benzenemethylal', 'Benzaldehyde FFC', 'Benzene carbaldehyde', 'Benzene carboxaldehyde', 'benzanoaldehyde', 'Benzylaldehyde', 'Benzoyl hydride', 'NCI-C56133', 'Benzoic acid aldehyde', 'FEMA No. 2127', 'Caswell No. 076', 'Phenylformaldehyde', 'Benzaldehyde (natural)', 'NSC 7917', 'CCRIS 2376', 'HSDB 388', 'NSC-7917', 'EINECS 202-860-4', 'UNII-TA269SD04T', 'EPA Pesticide Chemical Code 008601', 'TA269SD04T', 'DTXSID8039241', 'CHEBI:17169', 'AI3-09931', 'DTXCID90134', 'NSC7917', 'EC 202-860-4', 'BENZALDEHYDE (II)', 'BENZALDEHYDE [II]', 'BENZALDEHYDE (MART.)', 'BENZALDEHYDE [MART.]', 'BENZALDEHYDE (USP IMPURITY)', 'BENZALDEHYDE [USP IMPURITY]', 'FENTANYL IMPURITY E (EP IMPURITY)', 'FENTANYL IMPURITY E [EP IMPURITY]', 'TRIBENOSIDE IMPURITY C (EP IMPURITY)', 'TRIBENOSIDE IMPURITY C [EP IMPURITY]', 'BENZYL ALCOHOL IMPURITY A (EP IMPURITY)', 'BENZYL ALCOHOL IMPURITY A [EP IMPURITY]', 'FENTANYL CITRATE IMPURITY E (EP IMPURITY)', 'FENTANYL CITRATE IMPURITY E [EP IMPURITY]', 'AMFETAMINE SULFATE IMPURITY D (EP IMPURITY)', 'AMFETAMINE SULFATE IMPURITY D [EP IMPURITY]', 'BENZALKONIUM CHLORIDE IMPURITY B (EP IMPURITY)', 'BENZALKONIUM CHLORIDE IMPURITY B [EP IMPURITY]', 'GLYCOPYRRONIUM BROMIDE IMPURITY F (EP IMPURITY)', 'GLYCOPYRRONIUM BROMIDE IMPURITY F [EP IMPURITY]', 'HYDROUS BENZOYL PEROXIDE IMPURITY A (EP IMPURITY)', 'HYDROUS BENZOYL PEROXIDE IMPURITY A [EP IMPURITY]', 'BENZOYLL PEROXIDE HYDROUS IMPURITY A (EP IMPURITY)', 'BENZOYLL PEROXIDE HYDROUS IMPURITY A [EP IMPURITY]', 'benzenecarbaldehyde', 'Benzene carcaboxaldehyde', "Flavor and Extract Manufacturers' Association No. 2127", '202-860-4', 'Benzadehyde', 'Benzyaldehyde', 'Benzaldehyde [NF]', 'Benzaldehyde-formyl-d', '55279-75-9', 'Benzaldehyde-alpha-d1', 'MFCD00003299', 'Benzaldehyde, methyl-', 'CHEMBL15972', 'Phenylmethanal benzenecarboxaldehyde', 'Benzaldehyde (NF)', 'NCGC00091819-01', 'NCGC00091819-02', 'Benzaldehyde-(phenyl-13C6)', 'benzaldehyd', 'Benzaldhyde', 'BDBM50139371', 'CAS-100-52-7', 'UN1990', 'Benzaldehyde-carbonyl-13C', 'benzaidehyde', 'benzaldehvde', 'benzaldehye', 'benzaldeyde', 'C7H6O', 'phenyl-methanone', 'Benzene methylal', 'Aromatic aldehyde', 'Benzoylwasserstoff', '(phenyl)methanone', 'PhCHO', '2vj1', 'WLN: VHR', 'BENZALDEHYDE [MI]', 'SCHEMBL573', 'BENZALDEHYDE [FCC]', 'BENZALDEHYDE [FHFI]', 'BENZALDEHYDE [HSDB]', 'BENZALDEHYDE [VANDF]', 'ghl.PD_Mitscher_leg0.170', 'BENZALDEHYDE [USP-RS]', 'Benzaldehyde, AR, >=99%', 'Benzaldehyde, LR, >=99%', 'BIDD:ER0249', 'BDBM60953', 'Benzaldehyde, analytical standard', 'Ald3-H_000012', 'Benzaldehyde, >=98%, FG, FCC', 'DGA48914', 'Ald3.1-H_000160', 'Ald3.1-H_000479', 'Ald3.1-H_000798', 'Tox21_113069', 'Tox21_113244', 'Tox21_200634', 's5574', 'STL194067', 'Benzaldehyde, for synthesis, 95.0%', 'AKOS000119172', 'Benzaldehyde [UN1990] [Class 9]', 'CCG-266041', 'NA 1989', 'Benzaldehyde, purum, >=98.0% (GC)', 'Benzaldehyde, ReagentPlus(R), >=99%', 'NCGC00091819-03', 'NCGC00258188-01', 'FF170798', 'PS-11959', 'Benzaldehyde, natural, >=98%, FCC, FG', 'DB-023673', 'B2379', 'Benzaldehyde, SAJ special grade, >=98.0%', 'NS00008510', 'Benzaldehyde, Vetec(TM) reagent grade, 98%', 'Formyl polystyrene resin - 0.8-1.5 mmol/g', 'Benzaldehyde 1000 microg/mL in Dichloromethane', 'Benzaldehyde 2000 microg/mL in Dichloromethane', 'Benzaldehyde, puriss. p.a., >=99.0% (GC)', 'C00193', 'C00261', 'D02314', 'A800226', 'Q372524', 'SR-01000944375', 'Benzaldehyde, purified by redistillation, >=99.5%', 'SR-01000944375-1', 'F1294-0144', 'InChI=1/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6', 'Benzaldehyde, European Pharmacopoeia (EP) Reference Standard', 'Benzaldehyde, United States Pharmacopeia (USP) Reference Standard', 'Benzaldehyde, Pharmaceutical Secondary Standard; Certified Reference Material'] |
From Pubchem