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123041-88-3 | Acetic acid, 2,2',2'',2'''-[1,2,4,5-benzenetetrayltetrakis(oxy)]tetrakis- (9CI)
CAS No: 123041-88-3 Catalog No: AG000JZI MDL No:
Product Description
Catalog Number:
AG000JZI
Chemical Name:
Acetic acid, 2,2',2'',2'''-[1,2,4,5-benzenetetrayltetrakis(oxy)]tetrakis- (9CI)
CAS Number:
123041-88-3
Molecular Formula:
C14H14O12
Molecular Weight:
374.2538
IUPAC Name:
2-[2,4,5-tris(carboxymethoxy)phenoxy]acetic acid
InChI:
InChI=1S/C14H14O12/c15-11(16)3-23-7-1-8(24-4-12(17)18)10(26-6-14(21)22)2-9(7)25-5-13(19)20/h1-2H,3-6H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)
InChI Key:
ZXIFHSJSJCIBLX-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cc(OCC(=O)O)c(cc1OCC(=O)O)OCC(=O)O
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.049g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
374.254g/mol
Monoisotopic Mass:
374.049g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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