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Diphenyl suberate

HCID 616217
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Basic information

CAS
16868-07-8
Standard SMILES
O=C(CCCCCCC(=O)Oc1ccccc1)Oc1ccccc1
InChIKey
NOPGQWZBTYTFAP-UHFFFAOYSA-N
Molecular formula
C20H22O4
Average molar mass
326.4 g/mol
Monoisotopic mass
326.15180918

Names & identifiers

Preferred name
Diphenyl suberate
IUPAC
diphenyl octanedioate
English name
Diphenyl suberate
Molecular weight
0

Names & synonyms

Diphenyl suberate16868-07-8DTXSID20346896RefChem:338931DTXCID50297968NOPGQWZBTYTFAP-UHFFFAOYSA-Ndiphenyl octanedioateSCHEMBL43568Suberic acid diphenyl esterOctanedioic acid diphenyl ester

Database identifiers

CAS
16868-07-8
PubChem CID
616217
DTXSID
DTXSID20346896
Nikkaji
J150.730C

Properties

Computed structural propertiesFilling in

XLogP
4.8
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
24
Formal charge
0
Complexity
332

Physicochemical properties

CAS DataBase Reference
16868 · 16868-07-8

Related reactions

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Compound notes

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