Chemical ID: 6529838

c1cc(cc(c1)O)[N+](=O)[O-]
Chemical ID:
6529838
Name [?]:
3-nitrophenol
SMILES [?]:
c1cc(cc(c1)O)[N+](=O)[O-]
InChi [?]:
InChI=1/C6H5NO3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H
InChi Info:
AuxInfo=1/0/N:1,2,6,4,3,5,8,7,9,10/E:(9,10)/CRV:7.5/rA:10nCCCCCCON+OO-/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5NO3
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:0.17925
Area:286.656
Solvation:-6.98715
Coulombic:-27.3906
Bond Count [?]
All:10
Single:6
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:139.109
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.38
LogP (Chemaxon):1.72

Name Annotations

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Descriptor Annotations

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