Basic information
- CAS
1092460-50-8- Standard SMILES
Cc1cc(Br)c(Cl)cc1O- InChIKey
KZESEJZODZKOMW-UHFFFAOYSA-N- Molecular formula
- C7H6BrClO
- Average molar mass
- 221.48 g/mol
- Monoisotopic mass
- 219.92906
Names & identifiers
- Preferred name
- 4-Bromo-5-chloro-2-methylphenol
- IUPAC
- 4-bromo-5-chloro-2-methylphenol
- English name
- 4-bromo-5-chloro-2-methylphenol
- Molecular formula
- C7H6BrClO
- Molecular weight
- 221.48
Names & synonyms
4-BROMO-5-CHLORO-2-METHYLPHENOL1092460-50-8MFCD115019044-bromo-5-chloro-2-methyl-phenolSCHEMBL23239701DTXSID401303736AR2867AKOS027334888DA-39855CS-0194301EN300-1615104F631833
Show more names
Phenol, 4-bromo-5-chloro-2-methyl-
Database identifiers
- CAS
1092460-50-8- PubChem CID
- 45926142
- DTXSID
DTXSID401303736
Properties
Computed structural properties
- XLogP
- 3.3
- 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
- 120
Physicochemical properties
- Boiling point
- 280.6 · 280.6±35.0 °C(Predicted)
- Density
- 1.674 · 1.674±0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- pka
- 8.8 · 8.80±0.23(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Suppliers8 total
苏州亚衍医药科技有限公司17715136450 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
上海平果医药科技有限公司021-20432229 · [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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