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17832-16-5 | 1,3,5-Benzenetricarboxylic acid, 1,3,5-tri-2-propen-1-yl ester
CAS No: 17832-16-5 Catalog No: AG0025YC MDL No:MFCD00008647
Product Description
Catalog Number:
AG0025YC
Chemical Name:
1,3,5-Benzenetricarboxylic acid, 1,3,5-tri-2-propen-1-yl ester
CAS Number:
17832-16-5
Molecular Formula:
C18H18O6
Molecular Weight:
330.3319
MDL Number:
MFCD00008647
IUPAC Name:
tris(prop-2-enyl) benzene-1,3,5-tricarboxylate
InChI:
InChI=1S/C18H18O6/c1-4-7-22-16(19)13-10-14(17(20)23-8-5-2)12-15(11-13)18(21)24-9-6-3/h4-6,10-12H,1-3,7-9H2
InChI Key:
VOSUIKFOFHZNED-UHFFFAOYSA-N
SMILES:
C=CCOC(=O)c1cc(cc(c1)C(=O)OCC=C)C(=O)OCC=C
EC Number:
241-791-4
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.11g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.336g/mol
Monoisotopic Mass:
330.11g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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