Basic information
- CAS
6312-82-9- Standard SMILES
CCOc1cc(C=O)cc(I)c1O- InChIKey
WFAHCDLEWJKPJS-UHFFFAOYSA-N- Molecular formula
- C9H9IO3
- Average molar mass
- 292.07 g/mol
- Monoisotopic mass
- 291.95964
Names & identifiers
- Preferred name
- 3-Ethoxy-4-hydroxy-5-iodobenzaldehyde
- IUPAC
- 3-ethoxy-4-hydroxy-5-iodobenzaldehyde
- English name
- 3-Ethoxy-4-hydroxy-5-iodobenzaldehyde
- Molecular formula
- C9H9IO3
- Molecular weight
- 292.07
Names & synonyms
3-ethoxy-4-hydroxy-5-iodobenzaldehyde6312-82-9DTXSID00285118RefChem:1067710DTXCID80236269MFCD01123247benzaldehyde, 3-ethoxy-4-hydroxy-5-iodo-NSC40555Oprea1_246589Oprea1_371977STK0326705-ethoxy-4-hydroxy-3-iodobenzaldehyde
Show more names
ZINC00562689VITAS-BB TBB005612ART-CHEM-BB B004214
CHEMBRDG-BB 60468153-ethoxy-4-hydroxy-5-iodo-benzaldehydeBenzaldehyde,3-ethoxy-4-hydroxy-5-iodo-SCHEMBL6801555AKOS B004214WFAHCDLEWJKPJS-UHFFFAOYSA-NALBB-024403BBL023556
Database identifiers
- CAS
6312-82-9- PubChem CID
- 237243
- DTXSID
DTXSID00285118
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Chemistry & industry
Suppliers8 total
山东宜仁药业有限公司531-87922518 15628888630 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Compound notes
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