Cas no 59976-12-4 (1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]-)
![1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]- structure](https://ossimg.kuujia.com/scimg/60000/59976-12-4x500.png)
59976-12-4 structure
Product Name:1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]-
CAS No:59976-12-4
MF:C17H14Br6O4
MW:761.714661121368
CID:1617928
Update Time:2024-09-13
1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]-
-
- Inchi： 1S/C17H14Br6O4/c18-9-1-11(20)15(12(21)2-9)26-7-17(5-24,6-25)8-27-16-13(22)3-10(19)4-14(16)23/h1-4,24-25H,5-8H2
- InChI Key： BHDSTKOBYRZUJW-UHFFFAOYSA-N
- SMILES： C(O)C(COC1=C(Br)C=C(Br)C=C1Br)(COC1=C(Br)C=C(Br)C=C1Br)CO
Computed Properties
- Exact Mass: 755.59902
Experimental Properties
- Density: 2.240±0.06 g/cm3(Predicted)
- Boiling Point: 671.6±50.0 °C(Predicted)
- PSA: 58.92
- pka: 13.57±0.10(Predicted)
1,3-Propanediol, 2,2-bis[(2,4,6-tribromophenoxy)methyl]- Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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