Cas no 50390-68-6 (Cyclopentanone,2-methyl-2-phenyl-)
50390-68-6 structure
Product Name:Cyclopentanone,2-methyl-2-phenyl-
CAS No:50390-68-6
MF:C12H14O
MW:174.238963603973
CID:382193
PubChem ID:349941
Update Time:2025-04-19
Cyclopentanone,2-methyl-2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanone,2-methyl-2-phenyl-
- 2-methyl-2-phenylcyclopentan-1-one
- 2-METHYL-2-PHENYL-CYCLOPENTANONE
- (+-) 2-Methyl-2-phenyl-cyclopentanon
- (S)-(-)-2-Methyl-2-phenyl-cyclopentanon
- 2-Methyl-2-phenyl-cyclopentanon-(1)
- Cyclopentanone,2-methyl-2-phenyl
- TYRYXIDSYINSHM-UHFFFAOYSA-N
- AKOS006289829
- NSC-409887
- NSC409887
- DTXSID70325378
- 2-methyl-2-phenylcyclopentanone
- 50390-68-6
- SCHEMBL512374
-
- Inchi： 1S/C12H14O/c1-12(9-5-8-11(12)13)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3
- InChI Key： TYRYXIDSYINSHM-UHFFFAOYSA-N
- SMILES： O=C1CCCC1(C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 174.10400
- Monoisotopic Mass: 174.104
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 203
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 1.038
- Boiling Point: 277°C at 760 mmHg
- Flash Point: 114.1°C
- Refractive Index: 1.534
- PSA: 17.07000
- LogP: 2.69730
Cyclopentanone,2-methyl-2-phenyl- Customs Data
- HS CODE：2914399090
- Customs Data：
China Customs Code:
2914399090Overview:
2914399090. Other aromatic ketones without other oxygen-containing groups. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acetone declared packaging
Summary:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%
Cyclopentanone,2-methyl-2-phenyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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