Basic information
- CAS
5739-37-7- Standard SMILES
O=C(CCc1ccccc1)c1ccc(Cl)cc1- InChIKey
GQNOPFDKLUGQEC-UHFFFAOYSA-N- Molecular formula
- C15H13ClO
- Average molar mass
- 244.71 g/mol
- Monoisotopic mass
- 244.06549272
Names & identifiers
- Preferred name
- 4'-Chloro-3-phenylpropiophenone
- IUPAC
- 1-(4-chlorophenyl)-3-phenylpropan-1-one
- English name
- 4'-CHLORO-3-PHENYLPROPIOPHENONE
- Molecular formula
- C15H13ClO
- Molecular weight
- 244.72
Names & synonyms
4'-CHLORO-3-PHENYLPROPIOPHENONE5739-37-71-(4-chlorophenyl)-3-phenylpropan-1-oneMFCD038429281-(4-chlorophenyl)-3-phenyl-propan-1-one1-Propanone,1-(4-chlorophenyl)-3-phenyl-1-Propanone, 1-(4-chlorophenyl)-3-phenyl-NSC61775SCHEMBL3078714p-chlorophenyl phenylethyl ketoneSCHEMBL27897046DTXSID50289525
Show more names
GQNOPFDKLUGQEC-UHFFFAOYSA-NNSC-61775UKRORGSYN-BB BBV-51186224-CHLORO-3-PHENYLPROPIOPHENONEAKOS009339220DS-10174SY109137DB-237789
Database identifiers
- CAS
5739-37-7- PubChem CID
- 247344
- DTXSID
DTXSID50289525- Nikkaji
- J1.853.694C
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 237
Physicochemical properties
- Melting point
- 78 °C · 78 °C
- Boiling point
- 386 · 386.0±25.0 °C(Predicted)
- Density
- 1.164 · 1.164±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
Chemistry & industry
Suppliers20 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
湖南氩氡医药科技有限公司13764359345 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
艾览（上海）化工科技有限公司400-668-9898 · [email protected]
上海思阔化学科技有限公司021-33758897 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Related reactions
4 records
Compound notes
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