CAS
18165-68-9 Purity
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18165-68-9 Purity
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1,4-Benzenedicarboxylic acid dihexyl ester
CAS
1818-96-8
Catalog Number
ACM1818968
Category
Other Products
Molecular Weight
0
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Specification
Synonyms
1,4-Benzenedicarboxylic acid dihexyl ester
What is the molecular formula of 1,4-Benzenedicarboxylic acid dihexyl ester?
The molecular formula is C20H30O4.
What is the molecular weight of 1,4-Benzenedicarboxylic acid dihexyl ester?
The molecular weight is 334.4 g/mol.
What is the IUPAC name of 1,4-Benzenedicarboxylic acid dihexyl ester?
The IUPAC name is dihexyl benzene-1,4-dicarboxylate.
What is the InChI of 1,4-Benzenedicarboxylic acid dihexyl ester?
The InChI is InChI=1S/C20H30O4/c1-3-5-7-9-15-23-19(21)17-11-13-18(14-12-17)20(22)24-16-10-8-6-4-2/h11-14H,3-10,15-16H2,1-2H3.
What is the InChIKey of 1,4-Benzenedicarboxylic acid dihexyl ester?
The InChIKey is MLIPQTRXLNTCRS-UHFFFAOYSA-N.
What is the canonical SMILES of 1,4-Benzenedicarboxylic acid dihexyl ester?
The canonical SMILES is CCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCC.
What is the CAS number of 1,4-Benzenedicarboxylic acid dihexyl ester?
The CAS number is 1818-96-8.
What is the DSSTox Substance ID of 1,4-Benzenedicarboxylic acid dihexyl ester?
The DSSTox Substance ID is DTXSID00334054.
What is the XLogP3 value of 1,4-Benzenedicarboxylic acid dihexyl ester?
The XLogP3 value is 7.7.
Is 1,4-Benzenedicarboxylic acid dihexyl ester a canonicalized compound?
Yes, it is a canonicalized compound.
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CAS
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