Cas no 159874-90-5 (2-Thiophenecarboxaldehyde, 5-(dibutylamino)-)
159874-90-5 structure
Product Name:2-Thiophenecarboxaldehyde, 5-(dibutylamino)-
CAS No:159874-90-5
MF:C13H21NOS
MW:239.376942396164
CID:1339006
PubChem ID:15396910
Update Time:2025-04-20
2-Thiophenecarboxaldehyde, 5-(dibutylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiophenecarboxaldehyde, 5-(dibutylamino)-
- 5-(dibutylamino)thiophene-2-carbaldehyde
- DTXSID10572364
- UUGVLJPYDWMYQN-UHFFFAOYSA-N
- AKOS013661272
- DB-168038
- 5-(Dibutylamino)-2-thiophenecarboxaldehyde
- SCHEMBL50625
- 159874-90-5
-
- Inchi： 1S/C13H21NOS/c1-3-5-9-14(10-6-4-2)13-8-7-12(11-15)16-13/h7-8,11H,3-6,9-10H2,1-2H3
- InChI Key： UUGVLJPYDWMYQN-UHFFFAOYSA-N
- SMILES： S1C(C=O)=CC=C1N(CCCC)CCCC
Computed Properties
- Exact Mass: 239.13453
- Monoisotopic Mass: 239.13438547g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 190
- 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: 4.4
- Topological Polar Surface Area: 48.6?2
Experimental Properties
- PSA: 20.31
2-Thiophenecarboxaldehyde, 5-(dibutylamino)- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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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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