Cas no 4270-73-9 (1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]-)
![1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]- structure](https://ossimg.kuujia.com/scimg/4500/4270-73-9x500.png)
4270-73-9 structure
Product Name:1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]-
CAS No:4270-73-9
MF:C12H18O3
MW:210.269524097443
CID:1515069
PubChem ID:12857484
Update Time:2025-04-21
1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]-
- 2-((benzyloxy)methyl)-2-methylpropane-1,3-diol
- AT35914
- KOQGIHZSLVPISI-UHFFFAOYSA-N
- 4270-73-9
- 2-{(benzyloxy)methyl}-2-methylpropane-1,3-diol
- 2-Benzyloxymethyl-2-methyl-1,3-propanediol
- SCHEMBL5555534
-
- Inchi： 1S/C12H18O3/c1-12(8-13,9-14)10-15-7-11-5-3-2-4-6-11/h2-6,13-14H,7-10H2,1H3
- InChI Key： KOQGIHZSLVPISI-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)CC(C)(CO)CO
Computed Properties
- Exact Mass: 210.12564
- Monoisotopic Mass: 210.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 160
- 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: 0.9
- Topological Polar Surface Area: 49.7?2
Experimental Properties
- PSA: 49.69
1,3-Propanediol, 2-methyl-2-[(phenylmethoxy)methyl]- Related Literature
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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