Basic information
- CAS
178686-24-3- Standard SMILES
CCOc1cc(C=O)cc([N+](=O)[O-])c1O- InChIKey
MDWLNBVKBMKTKN-UHFFFAOYSA-N- Molecular formula
- C9H9NO5
- Average molar mass
- 211.17 g/mol
- Monoisotopic mass
- 211.04807239
Names & identifiers
- Preferred name
- 3-Ethoxy-4-hydroxy-5-nitrobenzaldehyde
- IUPAC
- 3-ethoxy-4-hydroxy-5-nitrobenzaldehyde
- English name
- 3-Ethoxy-4-hydroxy-5-nitrobenzaldehyde
- Molecular formula
- C9H9NO5
- Molecular weight
- 211.17
Names & synonyms
3-Ethoxy-4-hydroxy-5-nitrobenzaldehyde178686-24-3Benzaldehyde, 3-ethoxy-4-hydroxy-5-nitro-DTXSID90342825RefChem:279017DTXCID50293905605-831-8MDWLNBVKBMKTKN-UHFFFAOYSA-NMFCD000586783-Ethoxy-4-hydroxy-5-nitro-benzaldehyde5-ethoxy-4-hydroxy-3-nitrobenzaldehydeOprea1_755407
Show more names
AKOS B029213ASISCHEM R359825-NITROETHYLVANILLIN2-Ethoxy-4-formyl-6-nitrophenol3-ETHOXY-4-HYDROXY-5-NITROBENZALDEHYD4-Hydroxy-3-ethoxy-5-nitrobenzaldehydeBenzaldehyde, 3-ethoxy-4-hydroxy-5-nitro- (9CI)
SCHEMBL346053BBL023108SBB001751STK071920AKOS0002956995-nitro-3-ethoxy-4-hydroxybenzaldehydeDS-10163ST090905
Database identifiers
- CAS
178686-24-3- PubChem CID
- 584878
- DTXSID
DTXSID90342825- EC Number
- 605-831-8
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2912490090 · 2912490090
Safety & regulation
Safety data
- hs_code
- 2912490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers29 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海辅欣医药科技有限公司021-50872116 13391048226 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
上海睿升化工科技有限公司
Related reactions
260 records
Compound notes
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