Cas no 645395-07-9 (1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]-)
![1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]- structure](https://ossimg.kuujia.com/scimg/645500/645395-07-9x500.png)
645395-07-9 structure
Product Name:1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]-
CAS No:645395-07-9
MF:C24H34O7
MW:434.522568225861
CID:1679614
PubChem ID:71379704
Update Time:2025-04-21
1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]-
- 2-[[2,2-bis(hydroxymethyl)-3-phenylmethoxypropoxy]methyl]-2-(phenylmethoxymethyl)propane-1,3-diol
- 645395-07-9
- Bis[2,2-bis(hydroxymethyl)-3-(benzyloxy)propyl] ether
- DTXSID30802256
- 2,2'-[Oxybis(methylene)]bis{2-[(benzyloxy)methyl]propane-1,3-diol}
-
- Inchi： 1S/C24H34O7/c25-13-23(14-26,17-29-11-21-7-3-1-4-8-21)19-31-20-24(15-27,16-28)18-30-12-22-9-5-2-6-10-22/h1-10,25-28H,11-20H2
- InChI Key： NKTVZNSXNIHUBG-UHFFFAOYSA-N
- SMILES： O(CC(CO)(CO)COCC1C=CC=CC=1)CC(CO)(CO)COCC1C=CC=CC=1
Computed Properties
- Exact Mass: 434.23052
- Monoisotopic Mass: 434.23045342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 31
- Rotatable Bond Count: 16
- Complexity: 399
- 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: 0.3
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 108.61
1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-[(phenylmethoxy)methyl]- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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