Cas no 6285-40-1 (1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol)
![1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol structure](https://ossimg.kuujia.com/scimg/6500/6285-40-1x500.png)
6285-40-1 structure
Product Name:1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol
CAS No:6285-40-1
MF:C12H26O4
MW:234.332444667816
CID:1647582
PubChem ID:221174
Update Time:2025-04-21
1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol
- AC1M1TPB
- MolPort-003-065-803
- ZINC16005016
- F1382-0021
- N-(3-methyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide
- N-[(2Z)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide
- AC1M1TPB; MolPort-003-065-803; ZINC16005016; F1382-0021; N-(3-methyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide; N-[(2Z)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-5-nitrofuran-2-carboxamide;
- 1-[2-({1-[(Propan-2-yl)oxy]propan-2-yl}oxy)propoxy]propan-2-ol
- NSC5248
- NSC-5248
- DTXSID40978572
- 6285-40-1
-
- Inchi： 1S/C12H26O4/c1-9(2)15-8-12(5)16-11(4)7-14-6-10(3)13/h9-13H,6-8H2,1-5H3
- InChI Key： KIRAWOHZFACTBT-UHFFFAOYSA-N
- SMILES： O(C(C)COCC(C)O)C(C)COC(C)C
Computed Properties
- Exact Mass: 234.18318
- Monoisotopic Mass: 234.183
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 9
- Complexity: 161
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 47.9?2
Experimental Properties
- Density: 0.957
- Boiling Point: 300.7°C at 760 mmHg
- Flash Point: 135.7°C
- Refractive Index: 1.438
- PSA: 47.92
- LogP: 1.60240
1-(2-{[1-(propan-2-yloxy)propan-2-yl]oxy}propoxy)propan-2-ol Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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