Cas no 4161-40-4 (1,4-dibutoxybutane)
1,4-dibutoxybutane structure
Product Name:1,4-dibutoxybutane
CAS No:4161-40-4
MF:C12H26O2
MW:202.333644390106
CID:927149
PubChem ID:232577
Update Time:2025-04-19
1,4-dibutoxybutane Chemical and Physical Properties
Names and Identifiers
-
- 1,4-dibutoxybutane
- 1,4-Dibutoxy-butan
- 1,4-dibutoxy-butane
- 1,4-Dibutyloxy-butan
- 1.4-Dibutyloxy-butan
- AC1L5O6X
- AC1Q58U1
- AG-F-47975
- AR-1B7695
- CTK4I5032
- KST-1B5094
- NSC30233
- Tetramethylenglykol-dibutylaether
- SCHEMBL1477079
- NSC-30233
- DS-008415
- 4161-40-4
- DTXSID20283176
- Butane, 1,4-dibutoxy-
-
- Inchi： 1S/C12H26O2/c1-3-5-9-13-11-7-8-12-14-10-6-4-2/h3-12H2,1-2H3
- InChI Key： RWRVHUGUGAVJTL-UHFFFAOYSA-N
- SMILES： O(CCCC)CCCCOCCCC
Computed Properties
- Exact Mass: 202.19338
- Monoisotopic Mass: 202.193
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 11
- Complexity: 82.3
- 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: 3.8
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- Density: 0.845
- Boiling Point: 241.7°C at 760 mmHg
- Flash Point: 67.2°C
- Refractive Index: 1.424
- PSA: 18.46
- LogP: 3.40000
1,4-dibutoxybutane Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
4161-40-4 (1,4-dibutoxybutane) Related Products
- 143-22-6(2-2-(2-butoxyethoxy)ethoxyethan-1-ol)
- 1693-74-9(Tetrahydrofuran-d8, 99.5%)
- 2456-28-2(Di-n-decyl ether)
- 111-73-9(4-Ethoxybutan-1-ol)
- 112-48-1(1-(2-Butoxyethoxy)butane)
- 111-32-0(4-Methoxy-1-butanol)
- 112-73-2(Diethylene glycol dibutyl ether)
- 1786-94-3(3,6,9,12,15-Pentaoxanonadecan-1-ol)
- 13344-00-8(1,4-DIETHOXYBUTANE)
- 112-34-5(2-(2-Butoxyethoxy)ethanol)
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