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303016-29-7 | Propanoic acid, 2-[(6-oxo-6H-dibenzo[b,d]pyran-3-yl)oxy]-
CAS No: 303016-29-7 Catalog No: AG002ZKS MDL No:MFCD01238905
Product Description
Catalog Number:
AG002ZKS
Chemical Name:
Propanoic acid, 2-[(6-oxo-6H-dibenzo[b,d]pyran-3-yl)oxy]-
CAS Number:
303016-29-7
Molecular Formula:
C16H12O5
Molecular Weight:
284.2635
MDL Number:
MFCD01238905
IUPAC Name:
2-(6-oxobenzo[c]chromen-3-yl)oxypropanoic acid
InChI:
InChI=1S/C16H12O5/c1-9(15(17)18)20-10-6-7-12-11-4-2-3-5-13(11)16(19)21-14(12)8-10/h2-9H,1H3,(H,17,18)
InChI Key:
HWXAMSOIQRTWTO-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1ccc2c(c1)oc(=O)c1c2cccc1)C
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.068g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.267g/mol
Monoisotopic Mass:
284.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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