Ethyl 2-bromo-4-methylpentanoate
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Basic information
- Standard SMILES
CCOC(=O)C(Br)CC(C)C- InChIKey
CRWZYCOQBIFGSL-UHFFFAOYSA-N- Molecular formula
- C8H15BrO2
- Average molar mass
- 223.11 g/mol
- Monoisotopic mass
- 222.02554
Names & identifiers
- Preferred name
- Ethyl 2-bromo-4-methylpentanoate
- IUPAC
- ethyl 2-bromo-4-methylpentanoate
Names & synonyms
ethyl 2-bromo-4-methylpentanoate35657-97-7ethyl 2-bromo-4-methyl-pentanoateMFCD20483822Bromisocapronsaure-athylesterPentanoic acid, 2-bromo-4-methyl-, ethyl esterSCHEMBL1370661ethyl2-bromo-4-methylpentanoateCRWZYCOQBIFGSL-UHFFFAOYSA-Nalpha-Bromo-isocaproic acid, ethyl esterDA-06474SY355235
Show more names
2-bromo-4-methyl-pentanoic acid ethyl esterG66412F960437
Database identifiers
- PubChem CID
- 458111
- Nikkaji
- J60.803C
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 123
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Related reactions
2 records
Compound notes
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