Cas no 583-05-1 (1-Phenylpentane-1,4-dione)
1-Phenylpentane-1,4-dione structure
Product Name:1-Phenylpentane-1,4-dione
CAS No:583-05-1
MF:C11H12O2
MW:176.211783409119
MDL:MFCD00092889
CID:82576
PubChem ID:136371
Update Time:2025-04-18
1-Phenylpentane-1,4-dione Chemical and Physical Properties
Names and Identifiers
-
- 1-Phenylpentane-1,4-dione
- 1,4-dioxo-1-phenyl-pentane
- 1,4-Pentanedione,1-phenyl
- 1-phenyl-1,4-pentadione
- 1-phenyl-1,4-pentandione
- 1-Phenyl-1,4-pentanedione
- 1-Phenyl-pentane-1,4-dione
- BDBM22763
- 583-05-1
- 1-(phenyl)-pentane-1,4-dione
- AS-58611
- MFCD00092889
- AKOS005207126
- DTXSID90207021
- 1-(phenyl)pentane-1,4-dione
- 1,4-Pentanedione, 1-phenyl-
- SCHEMBL822901
- FT-0608217
- CHEMBL363855
- Q63399180
- 5-phenyl-2,5-pentanedione
- A869481
- DB-053179
- G61974
- DTXCID90129512
-
- MDL： MFCD00092889
- Inchi： 1S/C11H12O2/c1-9(12)7-8-11(13)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
- InChI Key： RBLXWIPBPPVLPU-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)CCC(C)=O
- BRN： 908230
Computed Properties
- Exact Mass: 176.08400
- Monoisotopic Mass: 176.08373
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 190
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 6
- XLogP3: nothing
- Topological Polar Surface Area: 34.1
Experimental Properties
- Density: 1.0558 (rough estimate)
- Boiling Point: 158-162°C 12mm
- Flash Point: 158-162°C/12mm
- Refractive Index: 1.5330
- Water Partition Coefficient: Not miscible in water.
- PSA: 34.14000
- LogP: 2.23850
1-Phenylpentane-1,4-dione 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%
1-Phenylpentane-1,4-dione Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019111268-5g |
1-Phenylpentane-1,4-dione |
583-05-1 | 95% | 5g |
$275.22 | 2023-09-01 | |
| Alichem | A019111268-10g |
1-Phenylpentane-1,4-dione |
583-05-1 | 95% | 10g |
$461.76 | 2023-09-01 | |
| Alichem | A019111268-25g |
1-Phenylpentane-1,4-dione |
583-05-1 | 95% | 25g |
$841.33 | 2023-09-01 | |
| SHANG HAI XIANG HUI YI YAO Technology Co., Ltd. | CB33846-1g |
1-Phenylpentane-1,4-dione |
583-05-1 | 97% | 1g |
0.00 | 2021-07-09 | |
| SHANG HAI XIANG HUI YI YAO Technology Co., Ltd. | CB33846-5g |
1-Phenylpentane-1,4-dione |
583-05-1 | 97% | 5g |
1203.00 | 2021-07-09 | |
| TRC | P400271-1mg |
1-Phenylpentane-1,4-dione |
583-05-1 | 1mg |
$190.00 | 2023-05-17 | ||
| TRC | P400271-10mg |
1-Phenylpentane-1,4-dione |
583-05-1 | 10mg |
$1499.00 | 2023-05-17 | ||
| SHANG HAI XIANG HUI YI YAO Technology Co., Ltd. | CB33846-1g |
1-Phenylpentane-1,4-dione |
583-05-1 | 97% | 1g |
0.00 | 2022-04-26 | |
| SHANG HAI XIANG HUI YI YAO Technology Co., Ltd. | CB33846-5g |
1-Phenylpentane-1,4-dione |
583-05-1 | 97% | 5g |
￥1203 | 2023-09-15 | |
| Aaron | AR003FAM-1g |
1-Phenylpentane-1,4-dione |
583-05-1 | 96% | 1g |
$100.00 | 2025-02-10 |
1-Phenylpentane-1,4-dione Related Literature
-
Byeong Hyo Kim,Seolhee Bae,Ahra Go,Hyunseung Lee,Cheoloh Gong,Byung Min Lee Org. Biomol. Chem. 2016 14 265
-
Rikta Saha,Md Mumtaz Alam,Mymoona Akhter RSC Adv. 2015 5 12807
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Hyejin Cho,Richard Madden,Bilal Nisanci,Béla T?r?k Green Chem. 2015 17 1088
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4. Clemmensen reduction. Part IV. 1,4-DiketonesJ. G. St. C. Buchanan,B. R. Davis J. Chem. Soc. C 1967 1340
-
5. Facile control of regioselectivity in the reaction of tin enolates with α-halogeno carbonyls by additivesMakoto Yasuda,Tatsuhiro Oh-Hata,Ikuya Shibata,Akio Baba,Haruo Matsuda J. Chem. Soc. Perkin Trans. 1 1993 859
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