2-(4-Bromo-2-isopropylphenoxy)acetic acid
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Basic information
- CAS
685853-35-4- Standard SMILES
CC(C)c1cc(Br)ccc1OCC(=O)O- InChIKey
UMZGGTFNPCNZAT-UHFFFAOYSA-N- Molecular formula
- C11H13BrO3
- Average molar mass
- 273.12 g/mol
- Monoisotopic mass
- 272.00481
Names & identifiers
- Preferred name
- 2-(4-Bromo-2-isopropylphenoxy)acetic acid
- IUPAC
- 2-(4-bromo-2-propan-2-ylphenoxy)acetic acid
- English name
- 2-(4-BROMO-2-ISOPROPYLPHENOXY)ACETIC ACID
- Molecular formula
- C11H13BrO3
- Molecular weight
- 273.12
Names & synonyms
2-(4-BROMO-2-ISOPROPYLPHENOXY)ACETIC ACID685853-35-42-[4-bromo-2-(propan-2-yl)phenoxy]acetic acid2-(4-bromo-2-propan-2-ylphenoxy)acetic acid2-(4-bromo-2-isopropyl-phenoxy)acetic acid[4-bromo-2-(propan-2-yl)phenoxy]acetic acid2-[4-bromo-2-(methylethyl)phenoxy]acetic acid(4-bromo-2-isopropylphenoxy)acetic acidMFCD03847928SCHEMBL3188075KCB85335BBL023602
Show more names
Acetic acid, 2-[4-bromo-2-(1-methylethyl)phenoxy]-
SBB043635STL223970AKOS000274099VS-07460CS-0317327ST45050640
Database identifiers
- CAS
685853-35-4- PubChem CID
- 734890
- EC Number
- 189-674-6
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
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Compound notes
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