Chemical ID: 4734614

Cc1c(cccc1[N+](=O)[O-])C(=O)O
Chemical ID:
4734614
Name [?]:
2-methyl-3-nitro-benzoic acid
SMILES [?]:
Cc1c(cccc1[N+](=O)[O-])C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H7NO4
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:1.38542
Area:327.64
Solvation:-6.80558
Coulombic:-38.9702
Bond Count [?]
All:13
Single:8
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:181.146
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.63
LogP (Chemaxon):1.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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