Basic information
- CAS
847577-89-3- Standard SMILES
O=c1cc[nH]c2ccc(OCc3ccccc3)cc12- InChIKey
WEMMRLBJXSUNTG-UHFFFAOYSA-N- Molecular formula
- C16H13NO2
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.09462866
Names & identifiers
- Preferred name
- 6-(Benzyloxy)quinolin-4-ol
- IUPAC
- 6-phenylmethoxy-1H-quinolin-4-one
- English name
- 4-Quinolinol, 6-(phenylMethoxy)-
- Molecular formula
- C16H13NO2
- Molecular weight
- 251.28
Names & synonyms
6-(Benzyloxy)quinolin-4-ol847577-89-36-phenylmethoxy-1H-quinolin-4-one6-BENZYLOXY-1H-QUINOLIN-4-ONE6-benzyloxyquinolin-4-olSCHEMBL1486580DTXSID70656139WEMMRLBJXSUNTG-UHFFFAOYSA-N4-Quinolinol, 6-(phenylmethoxy)-6-(Benzyloxy)quinolin-4(1H)-oneMFCD26743521AKOS005888012
Show more names
6-Benzyloxy-quinolin-4-ol6-(Phenylmethoxy)-4-quinolinol
SB69611BS-29622DB-341598G11293
Database identifiers
- CAS
847577-89-3- PubChem CID
- 43532011
- DTXSID
DTXSID70656139
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 347
Physicochemical properties
- Boiling point
- 455.8 · 455.8±30.0 °C(Predicted)
- Density
- 1.256 · 1.256±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 4.38 · 4.38±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- 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-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers6 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
南京精瑞久安生物技术有限公司025-58196018 800028039 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
上海安米克化学品有限公司微信：18019252918 18019252918 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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