Cas no 175205-28-4 (1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one)
175205-28-4 structure
Product Name:1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one
CAS No:175205-28-4
MF:C20H19F3O
MW:332.359476327896
CID:111906
PubChem ID:5709420
Update Time:2025-04-18
1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one Chemical and Physical Properties
Names and Identifiers
-
- 1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one
- 1-(4-Isobutylphenyl)-3-[4-(trifluoroMethyl)phenyl]prop-2-en-1-one
- 1-[4-(2-methylpropyl)phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
- 2-Propen-1-one,1-[4-(2-methylpropyl)phenyl]-3-[4-(trifluoromethyl)phenyl]-
- 2-Propen-1-one,1-[4-(2-methylpropyl)phenyl]-3-[4-(trifluoromethyl)phenyl]
- NCTTXOGDBHGOMM-KPKJPENVSA-N
- 2-Propen-1-one, 1-[4-(2-methylpropyl)phenyl]-3-[4-(trifluoromethyl)phenyl]-
- 175205-28-4
- (E)-1-(4-isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one
- SCHEMBL25367255
-
- Inchi: 1S/C20H19F3O/c1-14(2)13-16-3-8-17(9-4-16)19(24)12-7-15-5-10-18(11-6-15)20(21,22)23/h3-12,14H,13H2,1-2H3/b12-7+
- InChI Key: NCTTXOGDBHGOMM-KPKJPENVSA-N
- SMILES: FC(C1C=CC(=CC=1)/C=C/C(C1C=CC(=CC=1)CC(C)C)=O)(F)F
Computed Properties
- Exact Mass: 332.13900
- Monoisotopic Mass: 332.13879971g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 5
- Complexity: 423
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.2
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 1.147
- Melting Point: 85-87°C
- Boiling Point: 408.1°Cat760mmHg
- Flash Point: 247.5°C
- Refractive Index: 1.54
- PSA: 17.07000
- LogP: 5.80000
1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one Customs Data
- HS CODE:2914700090
- Customs Data:
China Customs Code:
2914700090Overview:
2914700090 Halogenation of other ketones and quinones\Sulfonated derivative(Including nitrated and nitrosative derivatives). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acetone declared packaging
Summary:
HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%
1-(4-Isobutylphenyl)-3-(4-(trifluoromethyl)phenyl)prop-2-en-1-one Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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