Cas no 200133-29-5 (Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-)
![Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]- structure](https://ossimg.kuujia.com/scimg/200500/200133-29-5x500.png)
200133-29-5 structure
Product Name:Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-
CAS No:200133-29-5
MF:C13H18O3
MW:222.280224323273
CID:1391034
PubChem ID:67139840
Update Time:2025-04-20
Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-
- DB-086312
- SCHEMBL1732627
- GRHVYHNHQXYQFX-UHFFFAOYSA-N
- 200133-29-5
- [3-(tetrahydro-2-pyranyloxymethyl)phenyl]methanol
-
- Inchi： 1S/C13H18O3/c14-9-11-4-3-5-12(8-11)10-16-13-6-1-2-7-15-13/h3-5,8,13-14H,1-2,6-7,9-10H2
- InChI Key： GRHVYHNHQXYQFX-UHFFFAOYSA-N
- SMILES： O1CCCCC1OCC1C=CC=C(CO)C=1
Computed Properties
- Exact Mass: 222.12564
- Monoisotopic Mass: 222.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 196
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69
Benzenemethanol, 3-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]- Related Literature
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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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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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