Chemical ID: 6450485

CCC(c1ccc(cc1)Cl)C(C(=O)O)C(=O)O
Chemical ID:
6450485
Name [?]:
2-[1-(4-chlorophenyl)propyl]propanedioic acid
SMILES [?]:
CCC(c1ccc(cc1)Cl)C(C(=O)O)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H13ClO4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:7.86942
Area:425.853
Solvation:-2.77691
Coulombic:-53.5574
Bond Count [?]
All:17
Single:12
Double:5
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:256.682
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.06
LogP (Chemaxon):3.11

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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