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70460-18-3 | 2-(3-hydroxyphenyl)chromen-4-one
CAS No: 70460-18-3 Catalog No: AG005IW2 MDL No:
Product Description
Catalog Number:
AG005IW2
Chemical Name:
2-(3-hydroxyphenyl)chromen-4-one
CAS Number:
70460-18-3
Molecular Formula:
C15H10O3
Molecular Weight:
238.2381
IUPAC Name:
2-(3-hydroxyphenyl)chromen-4-one
InChI:
InChI=1S/C15H10O3/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-9,16H
InChI Key:
ISZWRZGKEWQACU-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)c1cc(=O)c2c(o1)cccc2
NSC Number:
22356
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.063g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.242g/mol
Monoisotopic Mass:
238.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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