Unii-HM0PW39IN5
Basic information
- CAS
6018-84-4- Standard SMILES
CC[NH2+]CC.Nc1ccc(C(=O)[O-])cc1- InChIKey
XMYMCNNZVQZVJW-UHFFFAOYSA-N- Molecular formula
- C11H18N2O2
- Average molar mass
- 210.27 g/mol
- Monoisotopic mass
- 210.13682782
Names & identifiers
- Preferred name
- Unii-HM0PW39IN5
- IUPAC
- 4-aminobenzoate;diethylazanium
Names & synonyms
UNII-HM0PW39IN56018-84-4
Database identifiers
- CAS
6018-84-4- PubChem CID
- 22369
Properties
Computed structural properties
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 133
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Related reactions
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Compound notes
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