Cas no 88698-33-3 (Benzenamine, 2,6-dibromo-4-[3-(1,1-dimethylethyl)-5-oxazolidinyl]-)
88698-33-3 structure
Product Name:Benzenamine, 2,6-dibromo-4-[3-(1,1-dimethylethyl)-5-oxazolidinyl]-
CAS No:88698-33-3
MF:C13H18Br2N2O
MW:378.102821826935
CID:624118
PubChem ID:20134462
Update Time:2025-04-19
Benzenamine, 2,6-dibromo-4-[3-(1,1-dimethylethyl)-5-oxazolidinyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzenamine, 2,6-dibromo-4-[3-(1,1-dimethylethyl)-5-oxazolidinyl]-
- 2,6-dibromo-4-(3-tert-butyl-1,3-oxazolidin-5-yl)aniline
- 2,6-dibromo-4-(3-(tert-butyl)oxazolidin-5-yl)aniline
- SCHEMBL10614457
- DTXSID30602814
- 88698-33-3
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- Inchi: 1S/C13H18Br2N2O/c1-13(2,3)17-6-11(18-7-17)8-4-9(14)12(16)10(15)5-8/h4-5,11H,6-7,16H2,1-3H3
- InChI Key: LRLQBVCIKCRWSF-UHFFFAOYSA-N
- SMILES: BrC1C(=C(C=C(C=1)C1CN(CO1)C(C)(C)C)Br)N
Computed Properties
- Exact Mass: 377.97654g/mol
- Monoisotopic Mass: 375.97859g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 283
- 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: 3.2
- Topological Polar Surface Area: 38.5?2
Benzenamine, 2,6-dibromo-4-[3-(1,1-dimethylethyl)-5-oxazolidinyl]- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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