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73345-26-3 | Butanedioic acid, methylene-, ditetradecyl ester
CAS No: 73345-26-3 Catalog No: AG005EN2 MDL No:
Product Description
Catalog Number:
AG005EN2
Chemical Name:
Butanedioic acid, methylene-, ditetradecyl ester
CAS Number:
73345-26-3
Molecular Formula:
C33H62O4
Molecular Weight:
522.8430
IUPAC Name:
ditetradecyl 2-methylidenebutanedioate
InChI:
InChI=1S/C33H62O4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-36-32(34)30-31(3)33(35)37-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h3-30H2,1-2H3
InChI Key:
WWYLBXDBGNFKGY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCOC(=O)CC(=C)C(=O)OCCCCCCCCCCCCCC
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
522.465g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
522.855g/mol
Monoisotopic Mass:
522.465g/mol
Rotatable Bond Count:
31
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
13.8
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