2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, methyl ester

Base Information

• Chemical Name: 2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, methyl ester
• CAS No.: 55571-74-9
• Molecular Formula: C12H12O3
• Molecular Weight: 204.225
• DSSTox Substance ID: DTXSID60457950
• Nikkaji Number: J1.872.844C
• Mol file: 55571-74-9.mol

Synonyms:55571-74-9;methyl 4-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylate;Methyl 4-oxo-2,3-dihydro-1H-naphthalene-2-carboxylate;2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, methyl ester;SCHEMBL8911487;DTXSID60457950;WS-02450;1-Oxotetralin-3-carboxylic acid methyl ester;D86781;EN300-9506532

Chemical Property of 2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, methyl ester

Chemical Property:

• PSA: 43.37000
• LogP: 1.60470
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 204.078644241
• Heavy Atom Count: 15
• Complexity: 272

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CC2=CC=CC=C2C(=O)C1