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1225-63-4

1225-63-4 | 9H-Xanthen-9-one, 3-hydroxy-2,4-dimethoxy-

CAS No: 1225-63-4 Catalog No: AG0017C6 MDL No:

Product Description

Catalog Number:
AG0017C6
Chemical Name:
9H-Xanthen-9-one, 3-hydroxy-2,4-dimethoxy-
CAS Number:
1225-63-4
Molecular Formula:
C15H12O5
Molecular Weight:
272.2528
IUPAC Name:
3-hydroxy-2,4-dimethoxyxanthen-9-one
InChI:
InChI=1S/C15H12O5/c1-18-11-7-9-12(16)8-5-3-4-6-10(8)20-14(9)15(19-2)13(11)17/h3-7,17H,1-2H3
InChI Key:
DQAQTPIWHUEPAU-UHFFFAOYSA-N
SMILES:
COc1c(O)c(OC)cc2c1oc1ccccc1c2=O

Properties

Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.068g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.256g/mol
Monoisotopic Mass:
272.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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