3,4-dihydro-2H-benzo[b][1,4]oxazin-8-ol
Basic information
- CAS
704879-73-2- Standard SMILES
Oc1cccc2c1OCCN2- InChIKey
CCRWZANKPSYLKJ-UHFFFAOYSA-N- Molecular formula
- C8H9NO2
- Average molar mass
- 151.16 g/mol
- Monoisotopic mass
- 151.06332853
Names & identifiers
- Preferred name
- 3,4-dihydro-2H-benzo[b][1,4]oxazin-8-ol
- IUPAC
- 3,4-dihydro-2H-1,4-benzoxazin-8-ol
- English name
- 2H-1,4-Benzoxazin-8-ol, 3,4-dihydro- (9CI)
- Molecular formula
- C8H9NO2
- Molecular weight
- 151.16
Names & synonyms
3,4-dihydro-2H-benzo[b][1,4]oxazin-8-ol704879-73-23,4-DIHYDRO-2H-1,4-BENZOXAZIN-8-OL2H-1,4-Benzoxazin-8-ol, 3,4-dihydro- (9CI)3,4-Dihydro-2H-benzo[1,4]oxazin-8-ol2H-1,4-BENZOXAZIN-8-OL, 3,4-DIHYDRO-SCHEMBL28459775DTXSID20652409AKOS006311161MB08144DB-024841CS-0270591
Show more names
3,4-dihydro-2H-benzob1,4oxazin-8-ol2H-1,4-Benzoxazin-8-ol, 3,4-dihydro3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZIN-8-OL,95% MIN(HPLC)
F20690EN300-29954713,4-Dihydro-2h-1,4-benzoxazin-8-ol;2h-1,4-benzoxazin-8-ol, 3,4-dihydro-;
Database identifiers
- CAS
704879-73-2- PubChem CID
- 29949697
- DTXSID
DTXSID20652409
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- Boiling point
- 301.9 · 301.9±42.0 °C(Predicted)
- Density
- 1.241 · 1.241±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.27 · 10.27±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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