2-Acetamidodecanoic acid
Basic information
- CAS
5440-41-5- Standard SMILES
CCCCCCCCC(NC(C)=O)C(=O)O- InChIKey
IFNBFNVQYOIJJC-UHFFFAOYSA-N- Molecular formula
- C12H23NO3
- Average molar mass
- 229.32 g/mol
- Monoisotopic mass
- 229.1677936
Names & identifiers
- Preferred name
- 2-Acetamidodecanoic acid
- IUPAC
- 2-acetamidodecanoic acid
- English name
- 2-acetamidodecanoic acid
- Molecular formula
- C12H23NO3
- Molecular weight
- 0
Names & synonyms
2-acetamidodecanoic acid78590-03-15440-41-5NSC20164SCHEMBL10603414DTXSID00281110NSC-20164AKOS013464958DS-012878EN300-10449935
Database identifiers
- CAS
5440-41-5- PubChem CID
- 227945
- DTXSID
DTXSID00281110
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 216
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Compound notes
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