Cas no 35161-88-7 (Nonanoic acid, 4-chlorobutyl ester)
35161-88-7 structure
Product Name:Nonanoic acid, 4-chlorobutyl ester
CAS No:35161-88-7
MF:C13H25ClO2
MW:248.789403676987
CID:291648
PubChem ID:15888404
Update Time:2025-04-19
Nonanoic acid, 4-chlorobutyl ester Chemical and Physical Properties
Names and Identifiers
-
- Nonanoic acid, 4-chlorobutyl ester
- 4-chlorobutyl nonanoate
- DTXSID80579148
- 35161-88-7
-
- Inchi： 1S/C13H25ClO2/c1-2-3-4-5-6-7-10-13(15)16-12-9-8-11-14/h2-12H2,1H3
- InChI Key： RZFZERXIXGTWOI-UHFFFAOYSA-N
- SMILES： ClCCCCOC(CCCCCCCC)=O
Computed Properties
- Exact Mass: 248.1543077g/mol
- Monoisotopic Mass: 248.1543077g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 12
- Complexity: 160
- 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: 5
- Topological Polar Surface Area: 26.3?2
Nonanoic acid, 4-chlorobutyl ester Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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