Cas no 400709-59-3 (1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI))
![1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI) structure](https://ossimg.kuujia.com/scimg/401000/400709-59-3x500.png)
400709-59-3 structure
Product Name:1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI)
CAS No:400709-59-3
MF:C7H11NO
MW:125.168341875076
CID:325727
PubChem ID:19432877
Update Time:2025-04-19
1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI)
- 1-AAZABICYCLO[2.2.1]HEPTANE-3-CARBALDEHYDE
- 1-Azabicyclo[2.2.1]heptane-3-carbaldehyde
- DTXSID90598789
- 400709-59-3
- SCHEMBL8935420
-
- Inchi： 1S/C7H11NO/c9-5-7-4-8-2-1-6(7)3-8/h5-7H,1-4H2
- InChI Key： KSWRLFRZGARPMG-UHFFFAOYSA-N
- SMILES： O=CC1CN2CCC1C2
Computed Properties
- Exact Mass: 125.084063974g/mol
- Monoisotopic Mass: 125.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 135
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.1
- Topological Polar Surface Area: 20.3?2
1-Azabicyclo[2.2.1]heptane-3-carboxaldehyde(9CI) Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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