Cas no 680619-58-3 (Spiro[2.5]octane-1-carboxamide, (1S)- (9CI))
![Spiro[2.5]octane-1-carboxamide, (1S)- (9CI) structure](https://ossimg.kuujia.com/scimg/681000/680619-58-3x500.png)
680619-58-3 structure
Product Name:Spiro[2.5]octane-1-carboxamide, (1S)- (9CI)
CAS No:680619-58-3
MF:C9H15NO
MW:153.221502542496
CID:968559
PubChem ID:10080584
Update Time:2025-04-19
Spiro[2.5]octane-1-carboxamide, (1S)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Spiro[2.5]octane-1-carboxamide, (1S)- (9CI)
- SCHEMBL1633724
- (S)-Spiro[2.5]octane-1-carboxamide
- 680619-58-3
-
- Inchi： 1S/C9H15NO/c10-8(11)7-6-9(7)4-2-1-3-5-9/h7H,1-6H2,(H2,10,11)/t7-/m1/s1
- InChI Key： HDQONKBOIFNIBM-SSDOTTSWSA-N
- SMILES： O=C([C@H]1CC21CCCCC2)N
Computed Properties
- Exact Mass: 153.115364102g/mol
- Monoisotopic Mass: 153.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 43.1?2
Spiro[2.5]octane-1-carboxamide, (1S)- (9CI) Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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