Basic information
- CAS
53917-01-4- Standard SMILES
CCC(=O)Cc1ccc(OC)cc1- InChIKey
MUUSKLMAQKVLKY-UHFFFAOYSA-N- Molecular formula
- C11H14O2
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.09937969
Names & identifiers
- Preferred name
- 1-(4-Methoxyphenyl)butan-2-one
- IUPAC
- 1-(4-methoxyphenyl)butan-2-one
- English name
- 2-Butanone, 1-(4-methoxyphenyl)-
- Molecular formula
- C11H14O2
- Molecular weight
- 178.23
Names & synonyms
1-(4-methoxyphenyl)butan-2-one53917-01-4DTXSID00292266RefChem:1054438DTXCID302434082-Butanone, 1-(4-methoxyphenyl)-MFCD007980011-(4-methoxyphenyl)-2-butanoneNSC812441-(4-methoxyphenyl)-butanoneCHEMBL473378SCHEMBL7153605
Show more names
Ethyl p-methoxybenzyl ketone
1-(4-methoxyphenyl)butan-2-on2-Butanone, 1-p-methoxyphenyl-MUUSKLMAQKVLKY-UHFFFAOYSA-N1-(4-methoxy-phenyl)-2-butanone1-(4-methoxyphenyl)-butan-2-one1-(4-methoxy-phenyl)-butan-2-oneNSC-81244AB90944
Database identifiers
- CAS
53917-01-4- PubChem CID
- 255591
- DTXSID
DTXSID00292266- ChEMBL
CHEMBL473378- Nikkaji
- J1.909.497I
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Boiling point
- 265 · 265-270 °C
- Density
- 1.01 · 1.010
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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