Completing data — usually done within a minute
Basic information
- CAS
5820-27-9- Standard SMILES
C=C(C)COc1ccc(Br)cc1- InChIKey
KHQSRDPRMBZDDT-UHFFFAOYSA-N- Molecular formula
- C10H11BrO
- Average molar mass
- 227.1 g/mol
- Monoisotopic mass
- 225.99933
Names & identifiers
- Preferred name
- 1-Bromo-4-[(2-methylprop-2-en-1-yl)oxy]benzene
- IUPAC
- 1-bromo-4-(2-methylprop-2-enoxy)benzene
Names & synonyms
1-bromo-4-[(2-methylprop-2-en-1-yl)oxy]benzene5820-27-91-bromo-4-(2-methylprop-2-enoxy)benzene1-BROMO-4-[(2-METHYL-2-PROPEN-1-YL)OXY]BENZENEMFCD099394441-bromo-4-((2-methylallyl)oxy)benzene1-Bromo-4-[(2-methylallyl)oxy]benzeneNSC86579NCIOpen2_004956SCHEMBL10912649DTXSID20284603KHQSRDPRMBZDDT-UHFFFAOYSA-N
Show more names
FAA82027NSC37994NSC-37994NSC-865791-(2-Methylallyloxy)-4-bromobenzene1-bromo-4-(2-methylallyloxy)benzeneAKOS000185240SY162304
Database identifiers
- CAS
5820-27-9- PubChem CID
- 235995
- DTXSID
DTXSID20284603- EC Number
- 155-772-2
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 148
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Chemistry & industry
Suppliers7 total
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海林栎生物科技有限公司13761635123 · [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]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
3 records
Compound notes
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