Cas no 54013-49-9 (4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy-)
54013-49-9 structure
Product Name:4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy-
CAS No:54013-49-9
MF:C11H12O4
MW:208.210583686829
CID:355819
PubChem ID:11469836
Update Time:2024-03-01
4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy-
- 6,7-dimethoxy-2,3-dihydrochromen-4-one
- 6,7-dimethoxychroman-4-one
- DTXSID20466881
- Y12753
- 54013-49-9
- SCHEMBL12316567
- 6,7-Dimethoxy-2,3-dihydro-4H-chromen-4-one
- VLVVIOPAGWPOJW-UHFFFAOYSA-N
-
- Inchi： 1S/C11H12O4/c1-13-10-5-7-8(12)3-4-15-9(7)6-11(10)14-2/h5-6H,3-4H2,1-2H3
- InChI Key： VLVVIOPAGWPOJW-UHFFFAOYSA-N
- SMILES： O1CCC(C2C=C(C(=CC1=2)OC)OC)=O
Computed Properties
- Exact Mass: 208.07356
- Monoisotopic Mass: 208.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 241
- 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: 1.3
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
54013-49-9 (4H-1-Benzopyran-4-one, 2,3-dihydro-6,7-dimethoxy-) Related Products
- 491-37-2(3,4-dihydro-2H-1-benzopyran-4-one)
- 863309-86-8(5-methoxy-3,4-dihydro-2H-1-benzopyran-4-one)
- 39513-75-2(6-Methyl-4-chromanone)
- 5802-17-5(6-methoxy-3,4-dihydro-2H-1-benzopyran-4-one)
- 20351-79-5(8-Methoxychroman-4-one)
- 42327-52-6(7-Methoxychroman-4-one)
- 49660-56-2(8-Methyl-4-chromanone)
- 76240-27-2(7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one)
- 80096-64-6(6-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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