Cas no 49582-68-5 (3-Buten-2-one, 4-(dimethylamino)-4-methoxy-)
49582-68-5 structure
Product Name:3-Buten-2-one, 4-(dimethylamino)-4-methoxy-
CAS No:49582-68-5
MF:C7H13NO2
MW:143.183622121811
CID:2669526
Update Time:2023-08-06
3-Buten-2-one, 4-(dimethylamino)-4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 4-(Dimethylamino)-4-methoxy-3-buten-2-one
- 3-Buten-2-one, 4-(dimethylamino)-4-methoxy-
- NHWSRAGFVDXRMH-ALCCZGGFSA-N
- (3Z)-4-(Dimethylamino)-4-methoxy-3-buten-2-one #
-
- Inchi： 1S/C7H13NO2/c1-6(9)5-7(10-4)8(2)3/h5H,1-4H3/b7-5-
- InChI Key： NHWSRAGFVDXRMH-ALCCZGGFSA-N
- SMILES： O(C)/C(=C\C(C)=O)/N(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 150
- Topological Polar Surface Area: 29.5
3-Buten-2-one, 4-(dimethylamino)-4-methoxy- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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