Cas no 70983-53-8 (3-(3,5-Dimethoxyphenyl)-3-oxopropanenitrile)
70983-53-8 structure
Product Name:3-(3,5-Dimethoxyphenyl)-3-oxopropanenitrile
CAS No:70983-53-8
MF:C11H11NO3
MW:205.209943056107
CID:975919
Update Time:2023-08-02
3-(3,5-Dimethoxyphenyl)-3-oxopropanenitrile Chemical and Physical Properties
Names and Identifiers
-
- C20-24 ALKENYL SUCCINIC ANHYDRIDE (ASA 2024)
- 5-furandione, dihydro- mono-c20-24-2-alkenyl derivs.
- 2,5-Furandione,dihydro-,mono-C20-24-2-alkenyl derivs.
- 3-(3,5-dimethoxyphenyl)-3-oxopropanenitrile
- 3,5-Dimethoxybenzoylacetonitrile
- 3,5-dimethoxbenzoylacetonitrile
- PubChem11969
- Benzenepropanenitrile,3,5-dimethoxy-b-oxo-
- 8524AE
- BBL013465
- KM1382
- SBB093472
- STL124116
- A9329
- 2-(4-BOC-PIPERAZINYL)-2-(3-CYANO-PHENYL)ACETICACID
- 3-(3,5-Dimethoxyphenyl)-3-oxopropanenitrile
-
- Inchi： 1S/C11H11NO3/c1-14-9-5-8(11(13)3-4-12)6-10(7-9)15-2/h5-7H,3H2,1-2H3
- InChI Key： LKMXJVUYRSDTPZ-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C=C(C(CC#N)=O)C=1)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 256
- XLogP3: 1.4
- Topological Polar Surface Area: 59.3
3-(3,5-Dimethoxyphenyl)-3-oxopropanenitrile Related Literature
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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