Cas no 135644-36-9 (2-Propanone, 1-(propylamino)- (9CI))
135644-36-9 structure
Product Name:2-Propanone, 1-(propylamino)- (9CI)
CAS No:135644-36-9
MF:C6H13NO
MW:115.173521757126
CID:1019551
PubChem ID:20153956
Update Time:2025-04-20
2-Propanone, 1-(propylamino)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanone, 1-(propylamino)- (9CI)
- 1-(PROPYLAMINO)PROPAN-2-ONE
- QZMSIFNIJWDHBC-UHFFFAOYSA-N
- DB-282263
- SCHEMBL9557758
- 1-(propylamino)-2-propanone
- AKOS006221223
- 135644-36-9
- 2-Propanone, 1-(propylamino)-
- 2-oxopropyl-n-propylamine
-
- Inchi： 1S/C6H13NO/c1-3-4-7-5-6(2)8/h7H,3-5H2,1-2H3
- InChI Key： QZMSIFNIJWDHBC-UHFFFAOYSA-N
- SMILES： O=C(C)CNCCC
Computed Properties
- Exact Mass: 115.09979
- Monoisotopic Mass: 115.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 70.9
- 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: 0.4
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
2-Propanone, 1-(propylamino)- (9CI) Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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