Basic information
- CAS
71172-44-6- Standard SMILES
Cc1ccc(C)c(C(=O)C2CC2)c1- InChIKey
NRXRFPXXFISQQR-UHFFFAOYSA-N- Molecular formula
- C12H14O
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.10446507
Names & identifiers
- Preferred name
- Cyclopropyl(2,5-Dimethylphenyl)Methanone
- IUPAC
- cyclopropyl-(2,5-dimethylphenyl)methanone
- English name
- Cyclopropyl-(2,5-dimethylphenyl)methanone
- Molecular formula
- C12H14O
- Molecular weight
- 174.24
Names & synonyms
71172-44-6Cyclopropyl(2,5-Dimethylphenyl)MethanoneCyclopropyl 2,5-xylyl ketonecyclopropyl-(2,5-dimethylphenyl)methanoneMFCD00019225CYCLOPROPYL 2,5-DIMETHYLPHENYL KETONENSC71982EINECS 275-231-5Methanone,cyclopropyl(2,5-dimethylphenyl)-Methanone, cyclopropyl(2,5-dimethylphenyl)-DTXSID50221364NRXRFPXXFISQQR-UHFFFAOYSA-N
Show more names
(2,5-Dimethylphenyl)cyclopropylketone
NSC 71982NSC-71982AKOS009338061SY381094DB-319017CS-0368244NS00037162H80481
Database identifiers
- CAS
71172-44-6- PubChem CID
- 96397
- DTXSID
DTXSID50221364- EC Number
- 275-231-5
- Nikkaji
- J308.729H
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Melting point
- 5 · 5-6 °C
- Boiling point
- 95 · 95-98 °C(Press: 3-4 Torr)
- Density
- 1.07 · 1.070±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers10 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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