Cas no 199102-69-7 (4-n-Propylbenzoylacetonitrile)
4-n-Propylbenzoylacetonitrile structure
Product Name:4-n-Propylbenzoylacetonitrile
CAS No:199102-69-7
MF:C12H13NO
MW:187.237723112106
MDL:MFCD02260780
CID:908633
PubChem ID:2064032
Update Time:2025-04-19
4-n-Propylbenzoylacetonitrile Chemical and Physical Properties
Names and Identifiers
-
- 3-oxo-3-(4-propylphenyl)propanenitrile
- 4-n-Propylbenzoylacetonitrile
- AKOS BBR-002858
- BETA-OXO-4-PROPYL-BENZENEPROPANENITRILE
- 3-OXO-3-(4-PROPYL-PHENYL)-PROPIONITRILE
- SCHEMBL5793959
- MFCD02260780
- 1040724-13-7
- BS-50610
- Enamine_005194
- DTXSID90366400
- IDI1_007781
- AKOS000116594
- CS-0152419
- Z56886461
- EN300-04455
- E76392
- J-012860
- 199102-69-7
- HMS1408M02
-
- MDL： MFCD02260780
- Inchi： 1S/C12H13NO/c1-2-3-10-4-6-11(7-5-10)12(14)8-9-13/h4-7H,2-3,8H2,1H3
- InChI Key： KVXGLAIRWBFDBH-UHFFFAOYSA-N
- SMILES： O=C(CC#N)C1C=CC(=CC=1)CCC
Computed Properties
- Exact Mass: 187.10000
- Monoisotopic Mass: 187.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 230
- 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
- XLogP3: 2.3
- Topological Polar Surface Area: 40.9?2
Experimental Properties
- PSA: 40.86000
- LogP: 2.73548
4-n-Propylbenzoylacetonitrile Customs Data
- HS CODE：2926909090
- Customs Data：
China Customs Code:
2926909090Overview:
2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
4-n-Propylbenzoylacetonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 022387-1g |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 96% | 1g |
￡194.00 | 2022-02-28 | |
| Fluorochem | 022387-5g |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 96% | 5g |
￡654.00 | 2022-02-28 | |
| Fluorochem | 022387-25g |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 96% | 25g |
￡2362.00 | 2022-02-28 | |
| TRC | P835338-10mg |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | P835338-50mg |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 50mg |
$ 95.00 | 2022-06-03 | ||
| TRC | P835338-100mg |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 100mg |
$ 135.00 | 2022-06-03 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-EY284-200mg |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 95+% | 200mg |
623.0CNY | 2021-07-14 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-EY284-1g |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 95+% | 1g |
2181.0CNY | 2021-07-14 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-EY284-50mg |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 95+% | 50mg |
249.0CNY | 2021-07-14 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X06335-5g |
4-n-Propylbenzoylacetonitrile |
199102-69-7 | 95% | 5g |
￥4792.0 | 2024-07-18 |
4-n-Propylbenzoylacetonitrile Related Literature
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
199102-69-7 (4-n-Propylbenzoylacetonitrile) Related Products
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- 7391-28-8(4-Methylbenzoylacetonitrile)
- 39528-62-6(3-(4-tert-butylphenyl)-3-oxopropanenitrile)
- 5343-98-6(4-Oxo-4-phenylbutanenitrile)
- 39528-57-9(1-Naphthalenepropanenitrile,b-oxo-)
- 71292-11-0(4-(2-Cyanoacetyl)benzonitrile)
- 53882-81-8(3-(3-Methylphenyl)-3-oxopropanenitrile)
- 614-16-4(3-oxo-3-phenyl-propanenitrile)
- 10413-00-0(Benzenepentanenitrile, d-oxo-)
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