Benzoic acid, 2-((3,7-dimethyl-2,6-octadien-1-ylidene)amino)-, methyl ester

Base Information

• Chemical Name: Benzoic acid, 2-((3,7-dimethyl-2,6-octadien-1-ylidene)amino)-, methyl ester
• CAS No.: 67801-47-2
• Molecular Formula: C18H23NO2
• Molecular Weight: 285.3807
• European Community (EC) Number: 267-168-7
• UNII: 55494K367R
• Nikkaji Number: J60.474G
• Wikidata: Q27261270
• Mol file: 67801-47-2.mol

Synonyms:Methyl 2-((3,7-dimethyl-2,6-octadien-1-ylidene)amino)benzoate;UNII-55494K367R;EINECS 267-168-7;55494K367R;67801-47-2;Methyl 2-((3,7-dimethyl-2,6-octadienylidene)amino)benzoate;Methyl 2-[(3,7-dimethyl-2,6-octadienylidene)amino]benzoate;Benzoic acid, 2-((3,7-dimethyl-2,6-octadienylidene)amino)-, methyl ester;Benzoic acid, 2-((3,7-dimethyl-2,6-octadien-1-ylidene)amino)-, methyl ester;Benzoic acid, 2-[(3,7-dimethyl-2,6-octadienylidene)amino]-, methyl ester;SCHEMBL3506248;NIOSH/CB3030000;SCHEMBL18230846;Citral-methylanthranilate (Schiff base);Citral methylanthranilate, Schiff's base;LS-20524;CB30300000;Q27261270;2-(3,7-Dimethyl-2,6-octadienylideneamino)benzoic acid methyl ester;Anthranilic acid, N-(3,7-dimethyl-2,6-octadienylidene)-, methyl ester;Benzoic acid, 2-[(3,7-dimethyl-2,6-octadienylidene)amino]-,methyl ester;methyl 2 - ((3,7 - dimethyl - 2,6 - octadienylidene) amino)benzoate

Chemical Property of Benzoic acid, 2-((3,7-dimethyl-2,6-octadien-1-ylidene)amino)-, methyl ester

Chemical Property:

• Vapor Pressure: 4.34E-07mmHg at 25°C
• Refractive Index: 1.5740 (estimate)
• Boiling Point: 414.8°Cat760mmHg
• PKA: 3.42±0.50(Predicted)
• Flash Point: 159.3°C
• PSA: 38.66000
• Density: 0.95g/cm³
• LogP: 4.86820
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 285.172878976
• Heavy Atom Count: 21
• Complexity: 417

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CC=NC1=CC=CC=C1C(=O)OC)C)C
• Isomeric SMILES: CC(=CCC/C(=C/C=NC1=CC=CC=C1C(=O)OC)/C)C