Cas no 84585-79-5 (Cyclobutanecarboxylicacid, 2-(aminocarbonyl)-, trans- (9CI))
84585-79-5 structure
Product Name:Cyclobutanecarboxylicacid, 2-(aminocarbonyl)-, trans- (9CI)
CAS No:84585-79-5
MF:C6H9NO3
MW:143.140561819077
CID:707378
PubChem ID:13039556
Update Time:2025-04-19
Cyclobutanecarboxylicacid, 2-(aminocarbonyl)-, trans- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Cyclobutanecarboxylicacid, 2-(aminocarbonyl)-, trans- (9CI)
- (1R,2R)-2-carbamoylcyclobutane-1-carboxylic acid, trans
- DTXSID50516020
- AKOS027417463
- (1R,2R)-2-Carbamoylcyclobutane-1-carboxylic acid
- 84585-79-5
-
- Inchi： 1S/C6H9NO3/c7-5(8)3-1-2-4(3)6(9)10/h3-4H,1-2H2,(H2,7,8)(H,9,10)/t3-,4-/m1/s1
- InChI Key： VDJJUSIEPJADBA-QWWZWVQMSA-N
- SMILES： OC([C@@H]1CC[C@H]1C(N)=O)=O
Computed Properties
- Exact Mass: 143.058243149g/mol
- Monoisotopic Mass: 143.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 178
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.9
- Topological Polar Surface Area: 80.4?2
Cyclobutanecarboxylicacid, 2-(aminocarbonyl)-, trans- (9CI) Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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