Cas no 119102-99-7 (1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI))
![1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI) structure](https://ossimg.kuujia.com/scimg/119500/119102-99-7x500.png)
119102-99-7 structure
Product Name:1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI)
CAS No:119102-99-7
MF:C8H14N2O
MW:154.209561824799
CID:132072
PubChem ID:19887588
Update Time:2025-04-19
1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI)
- 1-azabicyclo[3.2.1]octane-5-carboxamide
- DTXSID20601018
- 1-azabicyclo[3.2.1]oct-5-ylcarboxamide
- 119102-99-7
- PHXUXNOMFOEYSS-UHFFFAOYSA-N
- SCHEMBL9049033
-
- Inchi： 1S/C8H14N2O/c9-7(11)8-2-1-4-10(6-8)5-3-8/h1-6H2,(H2,9,11)
- InChI Key： PHXUXNOMFOEYSS-UHFFFAOYSA-N
- SMILES： O=C(C12CCCN(CC1)C2)N
Computed Properties
- Exact Mass: 154.11072
- Monoisotopic Mass: 154.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 193
- 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: -0.4
- Topological Polar Surface Area: 46.3?2
Experimental Properties
- PSA: 46.33
1-Azabicyclo[3.2.1]octane-5-carboxamide(9CI) Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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