Cas no 69352-62-1 (2-bromo-2-ethyl-4-hydroxybutanamide)
69352-62-1 structure
Product Name:2-bromo-2-ethyl-4-hydroxybutanamide
CAS No:69352-62-1
MF:C6H12BrNO2
MW:210.068981170654
CID:1735286
PubChem ID:191907
Update Time:2025-04-21
2-bromo-2-ethyl-4-hydroxybutanamide Chemical and Physical Properties
Names and Identifiers
-
- 2-bromo-2-ethyl-4-hydroxybutanamide
- butanamide, 2-bromo-2-ethyl-4-hydroxy-
- 69352-62-1
- DTXSID70989075
- 2-Bromo-2-ethyl-4-hydroxybutyramide
- 2-Bromo-2-ethyl-4-hydroxybutanimidic acid
- 2-Brom-2-ethyl-4-hydroxybutyramide
-
- Inchi： 1S/C6H12BrNO2/c1-2-6(7,3-4-9)5(8)10/h9H,2-4H2,1H3,(H2,8,10)
- InChI Key： ZVBVBCHHZFGVAZ-UHFFFAOYSA-N
- SMILES： BrC(C(N)=O)(CC)CCO
Computed Properties
- Exact Mass: 209.00516
- Monoisotopic Mass: 209.00514g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 129
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- PSA: 63.32
2-bromo-2-ethyl-4-hydroxybutanamide Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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