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74670-11-4

74670-11-4 | 4H-1-Benzopyran-4-one,2-(2,6-dimethoxyphenyl)-

CAS No: 74670-11-4 Catalog No: AG005IHF MDL No:

Product Description

Catalog Number:
AG005IHF
Chemical Name:
4H-1-Benzopyran-4-one,2-(2,6-dimethoxyphenyl)-
CAS Number:
74670-11-4
Molecular Formula:
C17H14O4
Molecular Weight:
282.2907
IUPAC Name:
2-(2,6-dimethoxyphenyl)chromen-4-one
InChI:
InChI=1S/C17H14O4/c1-19-14-8-5-9-15(20-2)17(14)16-10-12(18)11-6-3-4-7-13(11)21-16/h3-10H,1-2H3
InChI Key:
NJOGNOKUONZMDI-UHFFFAOYSA-N
SMILES:
COc1cccc(c1c1cc(=O)c2c(o1)cccc2)OC

Properties

Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.089g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.295g/mol
Monoisotopic Mass:
282.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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