Basic information
- CAS
450412-22-3- Standard SMILES
COc1cccc(Br)c1I- InChIKey
HQIQCAXZVNDWEK-UHFFFAOYSA-N- Molecular formula
- C7H6BrIO
- Average molar mass
- 312.93 g/mol
- Monoisotopic mass
- 311.86467
Names & identifiers
- Preferred name
- 1-Bromo-2-iodo-3-methoxybenzene
- IUPAC
- 1-bromo-2-iodo-3-methoxybenzene
- English name
- 1-Bromo-2-iodo-3-methoxybenzene
- Molecular formula
- C7H6BrIO
- Molecular weight
- 312.93
Names & synonyms
1-Bromo-2-iodo-3-methoxybenzene450412-22-3DTXSID20434303RefChem:228399DTXCID203851293-Bromo-2-iodoanisoleMFCD18089327SCHEMBL4054307AKOS016004926AB91660DS-13981SY101796
Show more names
Benzene, 1-bromo-2-iodo-3-methoxy-1-Bromo-2-iodo-3-methoxybenzene ISO 9001：2015 REACH1-Bromo-2-iodo-3-methoxybenzene, 3-Bromo-2-iodophenyl methyl ether
CS-0097746O10381AS-813/435016571-bromo-2-iodo-3-methoxy-benzeneA872432F061632
Database identifiers
- CAS
450412-22-3- PubChem CID
- 10018436
- DTXSID
DTXSID20434303- Nikkaji
- J1.780.439A
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Melting point
- 63 · 63-65 °C
- Boiling point
- 287.1 · 287.1±25.0 °C(Predicted)
- Density
- 2.062 · 2.062±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- powder
- color
- Faint to light brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- HS Code
- 2909309090 · 2909309090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2909309090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers73 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Nanjing Fred Technology Co., Ltd+86-25-84696168 +86-15380713688 · [email protected]
Aladdin Scientific[email protected]
无锡探索者医药科技有限公司0510-0510-86396359 13382276200 · [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]
南京圣亿来化工有限公司19951936396 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
安徽合诺生物科技有限公司18455579438
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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