1,2-Benzenedicarboxylic Acid-d4 1-(4-Hydroxybutyl) Ester
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1,2-Benzenedicarboxylic Acid-d4 1-(4-Hydroxybutyl) Ester
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CAS No:
1346600-32-5
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Formula:
C12H14O5
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Chemical Name:
1,2-Benzenedicarboxylic Acid-d4 1-(4-Hydroxybutyl) Ester
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Synonyms:
1,2-Benzenedicarboxylic Acid-d4 1-(4-Hydroxybutyl) Ester;1346600-32-5
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CAS No:
1,2-Benzenedicarboxylic Acid-d4 1-(4-Hydroxybutyl) Ester Use and Manufacturing
An isotope labelled derivative of 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester, a phthalate ester derivative.
Computed Properties
Molecular Weight:242.26
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:242.10923053
Monoisotopic Mass:242.10923053
Topological Polar Surface Area:83.8
Heavy Atom Count:17
Complexity:264
Isotope Atom Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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