Basic information
- CAS
6797-13-3- Standard SMILES
CCc1nc2ccccc2o1- InChIKey
YPIFLXOVPCARGI-UHFFFAOYSA-N- Molecular formula
- C9H9NO
- Average molar mass
- 147.17 g/mol
- Monoisotopic mass
- 147.06841391
Names & identifiers
- Preferred name
- Benzoxazole, 2-ethyl-
- IUPAC
- 2-ethyl-1,3-benzoxazole
- English name
- 2-ETHYL-BENZOOXAZOLE
- Molecular formula
- C9H9NO
- Molecular weight
- 147.17
Names & synonyms
BENZOXAZOLE, 2-ETHYL-2-EthylbenzoxazoleBRN 0116485EINECS 229-868-0DTXSID40644784-27-00-01098 (Beilstein Handbook Reference)RefChem:118695DTXCID7045362229-868-02-Ethylbenzo[d]oxazole6797-13-32-Ethyl-1,3-benzoxazole
Show more names
2-ethyl-benzoxazol
2-ethyl-benzooxazoleMFCD01664178KX34AKG6FJSCHEMBL292136SCHEMBL292137SCHEMBL2184947SCHEMBL2621291SCHEMBL10503393
Database identifiers
- CAS
6797-13-3- PubChem CID
- 23239
- DTXSID
DTXSID4064478- UNII
- KX34AKG6FJ
- EC Number
- 229-868-0
- Nikkaji
- J41.885D
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 138
Physicochemical properties
- Boiling point
- 267.28 °C · 267.28°C (rough estimate)
- Density
- 1.1135 · 1.1135 (rough estimate)
- refractive index
- 1.567 · 1.5670 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- Colorless to light yellow Liquid
- EPA Substance Registry System
- 2 · Benzoxazole, 2-ethyl- (6797-13-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- 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: Benzoxazole, 2-ethyl-
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzoxazole, 2-ethyl-: ACTIVE
Suppliers25 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海毓川医药科技有限公司02161555100
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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