Naphthalen-1-yl hydroxycarbamate
Basic information
- CAS
31335-33-8- Standard SMILES
O=C(NO)Oc1cccc2ccccc12- InChIKey
QGQGWBYPKGXXQT-UHFFFAOYSA-N- Molecular formula
- C11H9NO3
- Average molar mass
- 203.19 g/mol
- Monoisotopic mass
- 203.05824315
Names & identifiers
- Preferred name
- Naphthalen-1-yl hydroxycarbamate
- IUPAC
- naphthalen-1-yl N-hydroxycarbamate
- English name
- naphthalen-1-yl N-hydroxycarbamate
- Molecular formula
- C11H9NO3
- Molecular weight
- 203.19
Names & synonyms
naphthalen-1-yl hydroxycarbamate31335-33-8naphthalen-1-yl N-hydroxycarbamateNSC197151-naphthyl N-hydroxycarbamateDTXSID00281014NSC-19715DB-277192CS-0133205Carbamic acid, hydroxy-, 1-naphthalenyl ester (9CI)
Database identifiers
- CAS
31335-33-8- PubChem CID
- 227741
- DTXSID
DTXSID00281014
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Density
- 1.345 · 1.345±0.06 g/cm3(Predicted)
- pka
- 8.53 · 8.53±0.23(Predicted)
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Compound notes
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