Cas no 7252-56-4 (1-Butanol, 1-butoxy-,1-acetate)
7252-56-4 structure
Product Name:1-Butanol, 1-butoxy-,1-acetate
CAS No:7252-56-4
MF:C10H20O3
MW:188.264003753662
CID:575188
PubChem ID:244343
Update Time:2025-04-19
1-Butanol, 1-butoxy-,1-acetate Chemical and Physical Properties
Names and Identifiers
-
- 1-Butanol, 1-butoxy-,1-acetate
- (+-)-(1-Butoxy-butyl)-acetat
- 1-Acetoxy-1-benzo[1,3]dioxol-5-yl-butan
- 1-Butoxybutyl-acetat
- AC1L5B0S
- AC1Q5Y2J
- acetic acid-(1-benzo[1,3]dioxol-5-yl-butyl ester)
- acetic acid-(1-butoxy-butyl ester)
- AG-J-40070
- AR-1A9763
- CTK4J9454
- Essigsaeure-(1-benzo[1,3]dioxol-5-yl-butylester)
- Essigsaeure-(1-butoxy-butylester)
- KST-1B6273
- NSC7034
- NSC-55207
- NSC55207
- 7252-56-4
- SCHEMBL3023337
-
- Inchi： 1S/C10H20O3/c1-4-6-8-12-10(7-5-2)13-9(3)11/h10H,4-8H2,1-3H3
- InChI Key： UAIJLTSVXNMMEG-UHFFFAOYSA-N
- SMILES： O(CCCC)C(CCC)OC(C)=O
Computed Properties
- Exact Mass: 188.1413
- Monoisotopic Mass: 188.14124450g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 134
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 0.923
- Boiling Point: 225.8°C at 760 mmHg
- Flash Point: 75.7°C
- Refractive Index: 1.422
- PSA: 35.53
1-Butanol, 1-butoxy-,1-acetate Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
7252-56-4 (1-Butanol, 1-butoxy-,1-acetate) Related Products
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