Cas no 52764-98-4 (Benzaldehyde,4-(3-azaspiro[5.5]undec-3-yl)-)
52764-98-4 structure
Product Name:Benzaldehyde,4-(3-azaspiro[5.5]undec-3-yl)-
CAS No:52764-98-4
MF:C17H23NO
MW:257.370624780655
CID:378468
PubChem ID:286061
Update Time:2025-04-19
Benzaldehyde,4-(3-azaspiro[5.5]undec-3-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,4-(3-azaspiro[5.5]undec-3-yl)-
- 4-(3-azaspiro[5.5]undecan-3-yl)benzaldehyde
- 4-(3-azaspiro[5.5]undec-3-yl)benzaldehyde
- AC1L64EF
- AC1Q6Q6E
- AG-J-87804
- AR-1F6060
- CTK4J6448
- NSC143756
- NSC-143756
- DTXSID30301496
- 52764-98-4
- AKOS006169910
-
- Inchi: 1S/C17H23NO/c19-14-15-4-6-16(7-5-15)18-12-10-17(11-13-18)8-2-1-3-9-17/h4-7,14H,1-3,8-13H2
- InChI Key: JFDOJXHCJRGBDD-UHFFFAOYSA-N
- SMILES: O=CC1C=CC(=CC=1)N1CCC2(CC1)CCCCC2
Computed Properties
- Exact Mass: 257.17809
- Monoisotopic Mass: 257.178
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 290
- 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
- XLogP3: 4.6
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- Density: 1.08
- Boiling Point: 426.2°C at 760 mmHg
- Flash Point: 165.4°C
- Refractive Index: 1.572
- PSA: 20.31
- LogP: 4.11480
Benzaldehyde,4-(3-azaspiro[5.5]undec-3-yl)- Related Literature
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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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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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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