Basic information
- CAS
7587-15-7- Standard SMILES
Oc1cc(Cl)c(I)cc1Cl- InChIKey
IAGXZGAELVSNRQ-UHFFFAOYSA-N- Molecular formula
- C6H3Cl2IO
- Average molar mass
- 288.89 g/mol
- Monoisotopic mass
- 287.86057
Names & identifiers
- Preferred name
- 2,5-Dichloro-4-iodophenol
- IUPAC
- 2,5-dichloro-4-iodophenol
- English name
- 2,5-dichloro-4-iodophenol
- Molecular formula
- C6H3Cl2IO
- Molecular weight
- 288.9
Names & synonyms
2,5-dichloro-4-iodophenol7587-15-7EINECS 231-495-3Phenol, 2,5-dichloro-4-iodo-DTXSID10226774RefChem:82792DTXCID40149265231-495-3Phenol,2,5-dichloro-4-iodo-SCHEMBL7594838MFCD00043986AKOS026732336
Show more names
NS00037734
Database identifiers
- CAS
7587-15-7- PubChem CID
- 82065
- DTXSID
DTXSID10226774- EC Number
- 231-495-3
- Nikkaji
- J307.890F
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- Melting point
- 74 °C · 74 °C
- Boiling point
- 299.9 · 299.9±40.0 °C(Predicted)
- Density
- 2.158 · 2.158±0.06 g/cm3(Predicted)
- pka
- 6.94 · 6.94±0.23(Predicted)
Chemistry & industry
Suppliers7 total
安徽合诺生物科技有限公司0555-2761852
苏州亚衍医药科技有限公司17715136450 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
安庆合生药业有限公司0556-5200952 18156626239 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
安庆合诚新材料科技有限公司18055625120 · [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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