Cas no 41945-72-6 (2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI))
![2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI) structure](https://ossimg.kuujia.com/scimg/42000/41945-72-6x500.png)
41945-72-6 structure
Product Name:2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI)
CAS No:41945-72-6
MF:C33H36O6
MW:528.635350227356
CID:334035
PubChem ID:6451805
Update Time:2025-04-19
2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI)
- 1,1'-[isopropylidenebis(p-phenyleneoxy)]bis[3-phenoxypropan-2-ol]
- 1-[4-[2-[4-(2-hydroxy-3-phenoxypropoxy)phenyl]propan-2-yl]phenoxy]-3-phenoxypropan-2-ol
- 1,1'-{Propane-2,2-diylbis[(4,1-phenylene)oxy]}bis(3-phenoxypropan-2-ol)
- SCHEMBL6939521
- EINECS 255-597-2
- 1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-phenoxypropan-2-ol)
- DTXSID20962095
- 41945-72-6
- NS00056695
-
- Inchi： 1S/C33H36O6/c1-33(2,25-13-17-31(18-14-25)38-23-27(34)21-36-29-9-5-3-6-10-29)26-15-19-32(20-16-26)39-24-28(35)22-37-30-11-7-4-8-12-30/h3-20,27-28,34-35H,21-24H2,1-2H3
- InChI Key： NDNKKBFJVPZPRQ-UHFFFAOYSA-N
- SMILES： O(CC(COC1C=CC=CC=1)O)C1C=CC(=CC=1)C(C)(C)C1C=CC(=CC=1)OCC(COC1C=CC=CC=1)O
Computed Properties
- Exact Mass: 528.251189
- Monoisotopic Mass: 528.251189
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 39
- Rotatable Bond Count: 14
- Complexity: 589
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 77.4
- XLogP3: 6.8
Experimental Properties
- Density: 1.176
- Boiling Point: 700.3°Cat760mmHg
- Flash Point: 377.3°C
- Refractive Index: 1.59
2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- (9CI) Related Literature
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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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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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