Basic information
- CAS
26726-75-0- Standard SMILES
O=c1oc2ccccc2n1CCO- InChIKey
LRLBEYAFJPUHME-UHFFFAOYSA-N- Molecular formula
- C9H9NO3
- Average molar mass
- 179.17 g/mol
- Monoisotopic mass
- 179.05824315
Names & identifiers
- Preferred name
- 2-Benzoxazolinone, 3-(2-hydroxyethyl)-
- IUPAC
- 3-(2-hydroxyethyl)-1,3-benzoxazol-2-one
- English name
- 3-(2-Hydroxyethyl)benzoxazol-2(3H)-one
- Molecular formula
- C9H9NO3
- Molecular weight
- 179.17
Names & synonyms
26726-75-03-(2-hydroxyethyl)-2,3-dihydro-1,3-benzoxazol-2-one2-BENZOXAZOLINONE, 3-(2-HYDROXYETHYL)-N-HydroxyethylbenzoxazoloneBRN 01627193-(2-Hydroxyethyl)-2-benzoxazolinoneDTXSID10181238RefChem:465580DTXCID20103729961-208-33-(2-hydroxyethyl)-1,3-benzoxazol-2-one3-(2-Hydroxyethyl)benzoxazol-2(3H)-one
Show more names
2(3H)-Benzoxazolone, 3-(2-hydroxyethyl)-3-(2-hydroxyethyl)-1,3-benzoxazol-2(3H)-oneOprea1_210250SCHEMBL7017010LRLBEYAFJPUHME-UHFFFAOYSA-NBBA726753-(2-hydroxyethyl)benzoxazolin-2-oneAKOS008132399
Database identifiers
- CAS
26726-75-0- PubChem CID
- 33587
- DTXSID
DTXSID10181238- EC Number
- 961-208-3
- Nikkaji
- J65.952E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 207
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers5 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海珂臻医药科技有限公司021-021-021-31663258 13795219287 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
1 records
Compound notes
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