Basic information
- CAS
6315-96-4- Standard SMILES
CCC(=O)c1ccc2ccccc2c1- InChIKey
QLYPHTMKMPIJNG-UHFFFAOYSA-N- Molecular formula
- C13H12O
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.088815
Names & identifiers
- Preferred name
- 1-(2-Naphthyl)propan-1-one
- IUPAC
- 1-naphthalen-2-ylpropan-1-one
- English name
- 1-(2-naphthyl)propan-1-one
- Molecular formula
- C13H12O
- Molecular weight
- 184.23
Names & synonyms
1-(naphthalen-2-yl)propan-1-one1-(2-Naphthyl)propan-1-one2'-Propionaphthone1-(2-naphthyl)-1-propanone1-Propanone, 1-(2-naphthalenyl)-R88N362L5V2-PROPIONAPHTHONEEINECS 228-648-1NSC-210442-PROPIONYLNAPHTHALENE.BETA.-PROPIONAPHTHONEDTXSID90212498
Show more names
Nsc210442-Propanoylnaphthalene1-(2-Naphtyl)-1-propanone1-phthalen-2-yl-propan-1-one
NSC 210441-(2-NAPHTHALENYL)-1-PROPANONERefChem:74197BETA-PROPIONAPHTHONEDTXCID90134989228-648-16315-96-41-naphthalen-2-yl-propan-1-one
Database identifiers
- CAS
6315-96-4- PubChem CID
- 80587
- DTXSID
DTXSID90212498- ChEMBL
CHEMBL464515- UNII
- R88N362L5V
- EC Number
- 228-648-1
- Nikkaji
- J206.904K
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Melting point
- 60 °C · 60°C
- Boiling point
- 313 °C · 313°C (estimate)
- Density
- 1.012 · 1.0120 (rough estimate)
- refractive index
- 1.5928 · 1.5928 (estimate)
- FDA UNII
- 88 N362L5V · R88N362L5V
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H412
- Precautionary statements
- 264 · P264-P270-P273-P301+P312+P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H412
- Precautionary statements
- P264-P270-P273-P301+P312+P330-P501
Chemistry & industry
Suppliers12 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
上海索本生物科技有限公司13023173052 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
南京英士奇生物科技有限公司18727012071 18727012071 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
2 records
Compound notes
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