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144267-98-1 | Methanone, [2-hydroxy-4-[2-(2-hydroxyethoxy)ethoxy]phenyl]phenyl-
CAS No: 144267-98-1 Catalog No: AG001J7K MDL No:
Product Description
Catalog Number:
AG001J7K
Chemical Name:
Methanone, [2-hydroxy-4-[2-(2-hydroxyethoxy)ethoxy]phenyl]phenyl-
CAS Number:
144267-98-1
Molecular Formula:
C17H18O5
Molecular Weight:
302.3218
IUPAC Name:
[2-hydroxy-4-[2-(2-hydroxyethoxy)ethoxy]phenyl]-phenylmethanone
InChI:
InChI=1S/C17H18O5/c18-8-9-21-10-11-22-14-6-7-15(16(19)12-14)17(20)13-4-2-1-3-5-13/h1-7,12,18-19H,8-11H2
InChI Key:
NRUQBELPFPLPDB-UHFFFAOYSA-N
SMILES:
OCCOCCOc1ccc(c(c1)O)C(=O)c1ccccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.115g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
302.326g/mol
Monoisotopic Mass:
302.115g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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