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Di-p-tolyl oxalate

HCID 44864
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Basic information

CAS
63867-33-4
Standard SMILES
Cc1cccc(OC(=O)C(=O)Oc2cccc(C)c2)c1
InChIKey
RRJJVVWKGKHXFO-UHFFFAOYSA-N
Molecular formula
C16H14O4
Average molar mass
270.28 g/mol
Monoisotopic mass
270.08920892

Names & identifiers

Preferred name
Di-p-tolyl oxalate
IUPAC
bis(3-methylphenyl) oxalate
English name
Oxalic acid bis(4-methylphenyl) ester
Molecular formula
C16H14O4
Molecular weight
270.28

Names & synonyms

Di-m-tolyl oxalate59672-19-4Di-p-tolyl oxalateBRN 3353147OXALIC ACID, BIS(p-TOLYL) ESTEREthanedioic acid, bis(4-methylphenyl)esterBis-p-kresylester kyseliny stavelove [Czech]SCHEMBL7922562bis(3-methylphenyl) ethanedioateDTXSID30213303Bis-p-kresylester kyseliny stavelove4-06-00-02114 (Beilstein Handbook Reference)
Show more names
Oxalic acid di(p-tolyl) esterOxalic acid bis(4-methylphenyl) esterEthanedioic acid, 1,2-bis(4-methylphenyl) ester
Ethanedioic acid, bis(4-methylphenyl)ester (9CI)

Database identifiers

CAS
63867-33-4
PubChem CID
44864
DTXSID
DTXSID30213303

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Formal charge
0
Complexity
318

Related reactions

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Compound notes

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