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1528-53-6 | Tripropyl benzene-1,2,4-tricarboxylate
CAS No: 1528-53-6 Catalog No: AG003V30 MDL No:MFCD00191686
Product Description
Catalog Number:
AG003V30
Chemical Name:
Tripropyl benzene-1,2,4-tricarboxylate
CAS Number:
1528-53-6
Molecular Formula:
C18H24O6
Molecular Weight:
336.3796
MDL Number:
MFCD00191686
IUPAC Name:
tripropyl benzene-1,2,4-tricarboxylate
InChI:
InChI=1S/C18H24O6/c1-4-9-22-16(19)13-7-8-14(17(20)23-10-5-2)15(12-13)18(21)24-11-6-3/h7-8,12H,4-6,9-11H2,1-3H3
InChI Key:
QEUYMNVHNSOBRS-UHFFFAOYSA-N
SMILES:
CCCOC(=O)c1cc(ccc1C(=O)OCCC)C(=O)OCCC
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.157g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.384g/mol
Monoisotopic Mass:
336.157g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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