Cas no 6622-27-1 (5-(butan-2-ylamino)pentan-1-ol)
6622-27-1 structure
Product Name:5-(butan-2-ylamino)pentan-1-ol
CAS No:6622-27-1
MF:C9H21NO
MW:159.269142866135
CID:1706440
PubChem ID:245050
Update Time:2025-04-21
5-(butan-2-ylamino)pentan-1-ol Chemical and Physical Properties
Names and Identifiers
-
- 5-(butan-2-ylamino)pentan-1-ol
- AKOS011512026
- AC1L6F1M
- AR-1G5479
- CTK5C3689
- NSC56576
- 5-sec-butylamino-pentanol-(1)
- AG-K-96042
- AC1Q7CR7
- 5-sek.-Butylamino-pentanol-(1)
- sek.-Butyl-(5-hydroxy-pentyl)-amin
- AKOS011512026; AC1L6F1M; AR-1G5479; CTK5C3689; NSC56576; 5-sec-butylamino-pentanol-(1); AG-K-96042; AC1Q7CR7; 5-sek.-Butylamino-pentanol-(1); sek.-Butyl-(5-hydroxy-pentyl)-amin;
- 5-(1-methyl-propylamino)-pentan-1-ol
- NSC-56576
- DTXSID90288552
- 6622-27-1
-
- Inchi： 1S/C9H21NO/c1-3-9(2)10-7-5-4-6-8-11/h9-11H,3-8H2,1-2H3
- InChI Key： BGEVWGPSWDXWJF-UHFFFAOYSA-N
- SMILES： OCCCCCNC(C)CC
Computed Properties
- Exact Mass: 159.16243
- Monoisotopic Mass: 159.162314293g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 7
- Complexity: 76
- 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: 1.4
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- PSA: 32.26
5-(butan-2-ylamino)pentan-1-ol Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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