Chemical ID: 3963746

COC(=O)c1cccc(c1N)[N+](=O)[O-]
Chemical ID:
3963746
Name [?]:
methyl 2-amino-3-nitro-benzoate
SMILES [?]:
COC(=O)c1cccc(c1N)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H8N2O4
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:1.58842
Area:350.298
Solvation:-7.16903
Coulombic:-47.78
Bond Count [?]
All:14
Single:9
Double:5
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:196.16
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:1.77
LogP (Chemaxon):2.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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