Cas no 171549-88-5 (Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI))
171549-88-5 structure
Product Name:Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI)
CAS No:171549-88-5
MF:C7H14N2O2
MW:158.198261737823
CID:905513
Update Time:2024-06-15
Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI)
- Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans-
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- Inchi： 1S/C7H14N2O2/c1-9(11-2)7(10)5-3-6(8)4-5/h5-6H,3-4,8H2,1-2H3/t5-,6-
- InChI Key： VOBDONZSRUUJBW-IZLXSQMJSA-N
- SMILES： [C@@H]1(C(N(OC)C)=O)C[C@@H](N)C1
Computed Properties
- Exact Mass: 158.10562
- Monoisotopic Mass: 158.106
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 155
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 55.6A^2
Experimental Properties
- Color/Form: White to off white powder
- PSA: 55.56
Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI) Security Information
- Storage Condition：2-8°C
Cyclobutanecarboxamide, 3-amino-N-methoxy-N-methyl-, trans- (9CI) Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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