2-(3-Methylphenoxy)ethyl acetate
Basic information
- CAS
6807-10-9- Standard SMILES
CC(=O)OCCOc1cccc(C)c1- InChIKey
MABPGSVYJMPWLZ-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.0942943
Names & identifiers
- Preferred name
- 2-(3-Methylphenoxy)ethyl acetate
- IUPAC
- 2-(3-methylphenoxy)ethyl acetate
Names & synonyms
6807-10-92-(3-methylphenoxy)ethyl acetateNSC190977m-tolyloxyethyl acetateSCHEMBL8895204DTXSID10307395MABPGSVYJMPWLZ-UHFFFAOYSA-NNSC-190977
Database identifiers
- CAS
6807-10-9- PubChem CID
- 303095
- DTXSID
DTXSID10307395
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
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Related reactions
1 records
Compound notes
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