Basic information
- CAS
313545-46-9- Standard SMILES
CC(C)Oc1ccc(Br)c(Cl)c1- InChIKey
AMQWLZQIHOTRTG-UHFFFAOYSA-N- Molecular formula
- C9H10BrClO
- Average molar mass
- 249.53 g/mol
- Monoisotopic mass
- 247.96036
Names & identifiers
- Preferred name
- 1-Bromo-2-chloro-4-isopropoxybenzene
- IUPAC
- 1-bromo-2-chloro-4-propan-2-yloxybenzene
- English name
- 1-BroMo-2-chloro-4-isopropoxy-benzene
- Molecular formula
- C9H10BrClO
- Molecular weight
- 249.53
Names & synonyms
1-bromo-2-chloro-4-isopropoxybenzene313545-46-91-bromo-2-chloro-4-isopropoxy-benzeneMFCD225436471-bromo-2-chloro-4-propan-2-yloxybenzene1-bromo-2-chloro-4-(propan-2-yloxy)benzeneSCHEMBL3756550AMQWLZQIHOTRTG-UHFFFAOYSA-NDTXSID001288926AKOS0272575291-bromo-2-chloro-4-iso-propoxybenzeneAB91647
Show more names
Benzene, 1-bromo-2-chloro-4-(1-methylethoxy)-
1-Bromo-2-chloro-4-isopropoxybenzene-d6CS-01953811-Bromo-2-chloro-4-[(propan-2-yl)oxy]benzeneF6326432989388-57-8
Database identifiers
- CAS
313545-46-9- PubChem CID
- 22735404
- DTXSID
DTXSID001288926
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- Boiling point
- 278.6 · 278.6±20.0 °C(Predicted)
- Density
- 1.426 · 1.426±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers7 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
5 records
Compound notes
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