Basic information
- CAS
6437-48-5- Standard SMILES
CC(=O)COc1cccc(C)c1- InChIKey
CMZUPPWOTAZLEZ-UHFFFAOYSA-N- Molecular formula
- C10H12O2
- Average molar mass
- 164.2 g/mol
- Monoisotopic mass
- 164.08372962
Names & identifiers
- Preferred name
- 1-(3-Methylphenoxy)-2-propanone
- IUPAC
- 1-(3-methylphenoxy)propan-2-one
- English name
- 1-(3-Methylphenoxy)-2-propanone
- Molecular formula
- C10H12O2
- Molecular weight
- 164.2
Names & synonyms
6437-48-51-(3-METHYLPHENOXY)-2-PROPANONE1-(3-methylphenoxy)propan-2-one1-(M-TOLYLOXY)PROPAN-2-ONENSC 211877NSC2118772-PROPANONE, 1-(3-METHYLPHENOXY)-SCHEMBL8976610DTXSID80309386CMZUPPWOTAZLEZ-UHFFFAOYSA-N1-(3-methylphenoxy)-propan-2-oneMFCD06659708
Show more names
AKOS008908166AB26138NSC-211877
Database identifiers
- CAS
6437-48-5- PubChem CID
- 309575
- DTXSID
DTXSID80309386
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 154
Chemistry & industry
Suppliers1 total
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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