Chemical ID: 4271796

CCCCCCOC(=O)c1cccc(c1)[N+](=O)[O-]
Chemical ID:
4271796
Name [?]:
hexyl 3-nitrobenzoate
SMILES [?]:
CCCCCCOC(=O)c1cccc(c1)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H17NO4
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:5.04827
Area:484.547
Solvation:-7.06539
Coulombic:-32.5175
Bond Count [?]
All:18
Single:13
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:251.278
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.21
LogP (Chemaxon):3.55

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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