Chemical ID: 4274682

CC(C)OC(=O)c1cc(c(cc1C(=O)O)C(=O)OC(C)C)C(=O)O
Chemical ID:
4274682
Name [?]:
2,5-bis(isopropoxycarbonyl)terephthalic acid
SMILES [?]:
CC(C)OC(=O)c1cc(c(cc1C(=O)O)C(=O)OC(C)C)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H18O8
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.72293
Area:544.995
Solvation:-4.90194
Coulombic:-90.5748
Bond Count [?]
All:24
Single:17
Double:7
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:338.309
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:2.89
LogP (Chemaxon):1.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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