4-Cyano-4-methylpentanoic acid

Base Information

• Chemical Name: 4-Cyano-4-methylpentanoic acid
• CAS No.: 27579-05-1
• Molecular Formula: C₇H₁₁NO₂
• Molecular Weight: 141.17
• European Community (EC) Number: 861-085-5
• Nikkaji Number: J2.641.867D

Synonyms:4-cyano-4-methylpentanoic acid;27579-05-1;4-cyano-4,4-dimethylbutanoic acid;starbld0041179;SCHEMBL15504;CBA57905;Pentanoic acid, 4-cyano-4-methyl-;MFCD19230341;AKOS006386001;DB-090647;EN300-114669;F2147-5455

Chemical Property of 4-Cyano-4-methylpentanoic acid

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 141.078978594
• Heavy Atom Count: 10
• Complexity: 175

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(CCC(=O)O)C#N

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