Basic information
- CAS
19798-93-7- Standard SMILES
c1ccc(C2CCNCO2)cc1- InChIKey
NXRSRCLQERAMPF-UHFFFAOYSA-N- Molecular formula
- C10H13NO
- Average molar mass
- 163.22 g/mol
- Monoisotopic mass
- 163.09971404
Names & identifiers
- Preferred name
- 2H-1,3-Oxazine, tetrahydro-6-phenyl-
- IUPAC
- 6-phenyl-1,3-oxazinane
- English name
- tetrahydro-6-phenyl-2H-1,3-oxazine
- Molecular formula
- C10H13NO
- Molecular weight
- 163.22
Names & synonyms
2H-1,3-Oxazine, tetrahydro-6-phenyl-Tetrahydro-6-phenyl-2H-1,3-oxazineEINECS 243-322-9DTXSID00864907RefChem:90084DTXCID00813374243-322-96-phenyl-1,3-oxazinane19798-93-7JZ4DTL2S9GSCHEMBL3732127NXRSRCLQERAMPF-UHFFFAOYSA-N
Show more names
NS00047690
Database identifiers
- CAS
19798-93-7- PubChem CID
- 89227
- DTXSID
DTXSID00864907- UNII
- JZ4DTL2S9G
- EC Number
- 243-322-9
- Nikkaji
- J225.283J
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Boiling point
- 94 °C · 94 °C(Press: 1 Torr)
- Density
- 1.034 · 1.034±0.06 g/cm3(Predicted)
- pka
- 7.7 · 7.70±0.40(Predicted)
- EPA Substance Registry System
- 2 H-1,3-Oxazine, · 2H-1,3-Oxazine, tetrahydro-6-phenyl- (19798-93-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2H-1,3-Oxazine, tetrahydro-6-phenyl-
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2H-1,3-Oxazine, tetrahydro-6-phenyl-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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