Cas no 140635-79-6 (Benzoic acid, 4-amino-3,5-dibromo-, (3-methyl-3-oxetanyl)methyl ester)
140635-79-6 structure
Product Name:Benzoic acid, 4-amino-3,5-dibromo-, (3-methyl-3-oxetanyl)methyl ester
CAS No:140635-79-6
MF:C12H13Br2NO3
MW:379.044522047043
CID:1307471
Update Time:2024-08-04
Benzoic acid, 4-amino-3,5-dibromo-, (3-methyl-3-oxetanyl)methyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-amino-3,5-dibromo-, (3-methyl-3-oxetanyl)methyl ester
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- Inchi: 1S/C12H13Br2NO3/c1-12(4-17-5-12)6-18-11(16)7-2-8(13)10(15)9(14)3-7/h2-3H,4-6,15H2,1H3
- InChI Key: ANSWZGVJPVDRHG-UHFFFAOYSA-N
- SMILES: C(OCC1(C)COC1)(=O)C1=CC(Br)=C(N)C(Br)=C1
Computed Properties
- Exact Mass: 376.92619
Experimental Properties
- Density: 1.735±0.06 g/cm3(Predicted)
- Boiling Point: 441.3±40.0 °C(Predicted)
- PSA: 61.55
- pka: -1.84±0.10(Predicted)
Benzoic acid, 4-amino-3,5-dibromo-, (3-methyl-3-oxetanyl)methyl ester Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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