Cas no 54131-57-6 (4-Nonanone, 1-chloro-)
4-Nonanone, 1-chloro- structure
Product Name:4-Nonanone, 1-chloro-
CAS No:54131-57-6
MF:C9H17ClO
MW:176.683682203293
CID:355370
PubChem ID:20386103
Update Time:2025-04-19
4-Nonanone, 1-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 4-Nonanone, 1-chloro-
- 1-chloro-4-Nonanone
- 1-chlorononan-4-one
- SCHEMBL11513853
- 54131-57-6
- FT-0714193
- DTXSID30606534
- ZCTKTQUONMEFHR-UHFFFAOYSA-N
- AKOS014777491
-
- Inchi： 1S/C9H17ClO/c1-2-3-4-6-9(11)7-5-8-10/h2-8H2,1H3
- InChI Key： ZCTKTQUONMEFHR-UHFFFAOYSA-N
- SMILES： ClCCCC(CCCCC)=O
Computed Properties
- Exact Mass: 176.09691
- Monoisotopic Mass: 176.0967929g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 7
- Complexity: 102
- 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: 2.7
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
4-Nonanone, 1-chloro- Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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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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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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