Cas no 71972-66-2 (4H-1-Benzopyran-4-one,3-methyl-2-phenyl-)
71972-66-2 structure
Product Name:4H-1-Benzopyran-4-one,3-methyl-2-phenyl-
CAS No:71972-66-2
MF:C16H12O2
MW:236.265284538269
CID:563861
PubChem ID:51459
Update Time:2025-04-19
4H-1-Benzopyran-4-one,3-methyl-2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 4H-1-Benzopyran-4-one,3-methyl-2-phenyl-
- 3-methyl-2-phenylchromen-4-one
- 4H-1-Benzopyran-4-one,3-methyl-2-phenyl-(9CI)
- 3-Methyl-2-phenyl-4H-1-benzopyran-4-one
- 3-methyl-2-phenyl-4H-chromen-4-one
- 3-Methyl-2-phenyl-chromen-4-on
- 3-methyl-2-phenyl-chromen-4-one
- 3-Methylflavon
- 3-Methylflavone
- 3-Metilflavone
- FLAVONE,3-METHYL
- REC 1-0025
- 3-Metilflavone [Italian]
- BRN 0180009
- CHEMBL2431806
- 4H-1-Benzopyran-4-one, 3-methyl-2-phenyl-(9CI)
- CCG-239779
- SCHEMBL694139
- DTXSID70222257
- HMS1439P02
- 4H-1-Benzopyran-4-one, 3-methyl-2-phenyl-
- 4H-1-Benzopyran-4-one, 3-methyl-2-phenyl- (9CI)
- Oprea1_779803
- methylflavone
- IDI1_014535
- 71972-66-2
- Maybridge3_003148
- FLAVONE, 3-METHYL-
-
- Inchi： 1S/C16H12O2/c1-11-15(17)13-9-5-6-10-14(13)18-16(11)12-7-3-2-4-8-12/h2-10H,1H3
- InChI Key： LPACBRAWRCXZGB-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2C(C(C)=C1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 236.08400
- Monoisotopic Mass: 236.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 363
- 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
- Topological Polar Surface Area: 26.3A^2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
Experimental Properties
- Density: 1.197
- Boiling Point: 374.7°C at 760 mmHg
- Flash Point: 170.1°C
- Refractive Index: 1.615
- PSA: 30.21000
- LogP: 3.76840
4H-1-Benzopyran-4-one,3-methyl-2-phenyl- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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