Cas no 4225-45-0 (2H-Pyran-2-one,4-methoxy-6-phenyl-)
4225-45-0 structure
Product Name:2H-Pyran-2-one,4-methoxy-6-phenyl-
CAS No:4225-45-0
MF:C12H10O3
MW:202.206003665924
CID:333494
PubChem ID:249888
Update Time:2025-04-19
2H-Pyran-2-one,4-methoxy-6-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyran-2-one,4-methoxy-6-phenyl-
- 4-methoxy-6-phenylpyran-2-one
- 4-methoxy-6-phenyl-2H-pyran-2-one
- 4-methoxy-6-phenyl-2-pyrone
- 4-Methoxy-6-phenyl-pyran-2-on
- 4-methoxy-6-phenyl-pyran-2-one
- 4-methoxyphenylcoumalin
- AC1L6PFR
- AC1Q69K9
- AR-1G3122
- CTK4I5941
- NSC68684
- 4225-45-0
- DTXSID10290450
- NSC-68684
-
- Inchi： 1S/C12H10O3/c1-14-10-7-11(15-12(13)8-10)9-5-3-2-4-6-9/h2-8H,1H3
- InChI Key： JRKYMPFHUAZGIS-UHFFFAOYSA-N
- SMILES： O1C(C=C(C=C1C1C=CC=CC=1)OC)=O
Computed Properties
- Exact Mass: 202.063
- Monoisotopic Mass: 202.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 309
- 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: 2.1
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
- LogP: 2.31540
2H-Pyran-2-one,4-methoxy-6-phenyl- Related Literature
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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