3-(5-methyl-2-furyl)benzoic Acid

Base Information

• Chemical Name: 3-(5-methyl-2-furyl)benzoic Acid
• CAS No.: 400746-01-2
• Molecular Formula: C₁₂H₁₀O₃
• Molecular Weight: 202.21
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID90399137
• Mol file: 400746-01-2.mol

Synonyms:3-(5-methyl-2-furyl)benzoic Acid;400746-01-2;3-(5-methylfuran-2-yl)benzoic acid;SCHEMBL13704119;DTXSID90399137;3-(5-methylfuran-2-yl)benzoicacid;MFCD04039129;AKOS004116970;SB61217;3-(5-Methyl-furan-2-yl)-benzoic acid;BS-37558;BB 0224080;CS-0359575;FT-0705818;3-(5-Methyl-2-furyl)benzoic acid, AldrichCPR

Chemical Property of 3-(5-methyl-2-furyl)benzoic Acid

Chemical Property:

• Vapor Pressure: 6.87E-06mmHg at 25°C
• Boiling Point: 362.5°C at 760 mmHg
• Flash Point: 173°C
• PSA: 50.44000
• Density: 1.215g/cm³
• LogP: 2.95320
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 202.062994177
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

3-(5-Methyl-2-furyl)benzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 22-36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(O1)C2=CC(=CC=C2)C(=O)O

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