Cas no 54131-63-4 (4-Undecanone, 1-chloro-)
4-Undecanone, 1-chloro- structure
Product Name:4-Undecanone, 1-chloro-
CAS No:54131-63-4
MF:C11H21ClO
MW:204.736842870712
CID:355364
PubChem ID:13215901
Update Time:2025-04-19
4-Undecanone, 1-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 4-Undecanone, 1-chloro-
- 1-chloro-4-Undecanone
- 1-chloroundecan-4-one
- SCHEMBL11605460
- 54131-63-4
- AKOS015388634
- FT-0717452
- 1-chloro-undecan-4-one
- DTXSID40528915
-
- Inchi： 1S/C11H21ClO/c1-2-3-4-5-6-8-11(13)9-7-10-12/h2-10H2,1H3
- InChI Key： MYXPHWLPWSQFTQ-UHFFFAOYSA-N
- SMILES： ClCCCC(CCCCCCC)=O
Computed Properties
- Exact Mass: 204.12823
- Monoisotopic Mass: 204.1280930g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 9
- Complexity: 123
- 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
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
4-Undecanone, 1-chloro- Related Literature
-
L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
-
Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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