Basic information
- CAS
29955-26-8- Standard SMILES
COc1cccc(CC(=O)c2ccccc2)c1- InChIKey
PCPRLBDYPYGZOX-UHFFFAOYSA-N- Molecular formula
- C15H14O2
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.09937969
Names & identifiers
- Preferred name
- 2-(3-Methoxyphenyl)-1-phenylethan-1-one
- IUPAC
- 2-(3-methoxyphenyl)-1-phenylethanone
- English name
- 2-(3-Methoxyphenyl)acetophenone
- Molecular formula
- C15H14O2
- Molecular weight
- 226.27
Names & synonyms
29955-26-82-(3-methoxyphenyl)-1-phenylethan-1-oneDTXSID70374866RefChem:251607DTXCID503258962-(3-Methoxyphenyl)acetophenone2-(3-methoxyphenyl)-1-phenylethanoneMFCD00446972Ethanone, 2-(3-methoxyphenyl)-1-phenyl-1-phenyl-2-(3-methoxyphenyl)ethanone2-(3-methoxyphenyl)-1-phenyl-ethanonem-methoxybenzyl phenyl ketone
Show more names
UKRORGSYN-BB BBV-5118580
SCHEMBL904248SCHEMBL4973181SCHEMBL30342076PCPRLBDYPYGZOX-UHFFFAOYSA-NEBA95526AKOS009338871SY074772DB-103556
Database identifiers
- CAS
29955-26-8- PubChem CID
- 2759614
- DTXSID
DTXSID70374866- Nikkaji
- J2.024.731B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Melting point
- 41 · 41-42 °C(Solv: ligroine (8032-32-4))
- Boiling point
- 187 · 187-189 °C(Press: 7 Torr)
- Density
- 1.1 · 1.100±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers10 total
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
15 records
Compound notes
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