Cas no 7748-07-4 (Butane, 1-(1-propenyloxy)-)
Butane, 1-(1-propenyloxy)- structure
Product Name:Butane, 1-(1-propenyloxy)-
CAS No:7748-07-4
MF:C7H14O
MW:114.185462474823
CID:536002
PubChem ID:53683911
Update Time:2025-04-19
Butane, 1-(1-propenyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Butane, 1-(1-propenyloxy)-
- DTXSID50705932
- 1-[(Prop-1-en-1-yl)oxy]butane
- 7748-07-4
- propenyl n-butyl ether
- SCHEMBL891970
-
- Inchi： 1S/C7H14O/c1-3-5-7-8-6-4-2/h4,6H,3,5,7H2,1-2H3
- InChI Key： PNKQANLVRCMVPD-UHFFFAOYSA-N
- SMILES： O(C=CC)CCCC
Computed Properties
- Exact Mass: 114.10452
- Monoisotopic Mass: 114.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 57.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.3
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Butane, 1-(1-propenyloxy)- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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