Cas no 505-03-3 (Hexanal, 5-oxo-)
Hexanal, 5-oxo- structure
Product Name:Hexanal, 5-oxo-
CAS No:505-03-3
MF:C6H10O2
MW:114.142402172089
CID:364786
PubChem ID:10953466
Update Time:2025-04-19
Hexanal, 5-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Hexanal, 5-oxo-
- 5-oxohexanal
- UCAQDIQSNVAWBD-UHFFFAOYSA-N
- Bisindolylmaleimide X, HCl
- 505-03-3
- 1,5-hexanedione
- Soyanal
- g-Acetylbutyraldehyde
- DTXSID00449475
- hexan-1,5-dione
- BIM 10
- CHEBI:173392
- SCHEMBL711379
-
- Inchi： 1S/C6H10O2/c1-6(8)4-2-3-5-7/h5H,2-4H2,1H3
- InChI Key： UCAQDIQSNVAWBD-UHFFFAOYSA-N
- SMILES： O=C(C)CCCC=O
Computed Properties
- Exact Mass: 114.0681
- Monoisotopic Mass: 114.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 86.5
- 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: -0.3
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
Hexanal, 5-oxo- Related Literature
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
505-03-3 (Hexanal, 5-oxo-) Related Products
- 502-49-8(Cyclooctanone)
- 502-72-7(Cyclopentadecanone)
- 112-12-9(2-Undecanone)
- 120-92-3(Cyclopentanone)
- 593-08-8(2-Tridecanone)
- 111-13-7(2-Octanone)
- 110-13-4(hexane-2,5-dione)
- 502-56-7(5-Nonanone)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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