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1726-23-4 | TRIMELLITIC ACID TRI-N-BUTYL ESTER
CAS No: 1726-23-4 Catalog No: AG003V2Z MDL No:MFCD00059424
Product Description
Catalog Number:
AG003V2Z
Chemical Name:
TRIMELLITIC ACID TRI-N-BUTYL ESTER
CAS Number:
1726-23-4
MDL Number:
MFCD00059424
IUPAC Name:
tributyl benzene-1,2,4-tricarboxylate
InChI:
InChI=1S/C21H30O6/c1-4-7-12-25-19(22)16-10-11-17(20(23)26-13-8-5-2)18(15-16)21(24)27-14-9-6-3/h10-11,15H,4-9,12-14H2,1-3H3
InChI Key:
RJIFVNWOLLIBJV-UHFFFAOYSA-N
EC Number:
217-038-0
UNII:
YK7E10APJM
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.204g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.465g/mol
Monoisotopic Mass:
378.204g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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