2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid

Base Information

• Chemical Name: 2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid
• CAS No.: 667413-76-5
• Molecular Formula: C11H13NO5
• Molecular Weight: 239.22
• DSSTox Substance ID: DTXSID90364168
• Wikidata: Q82147967
• Mol file: 667413-76-5.mol

Synonyms:2-methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid;667413-76-5;AKOS B013917;DTXSID90364168;BBL017300;MFCD03422270;STK443125;AKOS000308687;VS-06034;CS-0317388;2-methyl-2-(3-methyl-4-nitrophenoxy)propanoicacid

Chemical Property of 2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid

Chemical Property:

• Vapor Pressure: 2.76E-07mmHg at 25°C
• Boiling Point: 405°C at 760 mmHg
• Flash Point: 198.7°C
• PSA: 92.35000
• Density: 1.287g/cm³
• LogP: 2.66840
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 239.07937252
• Heavy Atom Count: 17
• Complexity: 310

Purity/Quality:

98%min ^*data from raw suppliers

2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)OC(C)(C)C(=O)O)[N+](=O)[O-]

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