Chemical ID: 7196668

Cn1c(c(cn1)Cl)C[NH3+]
Chemical ID:
7196668
Name [?]:
(4-chloro-2-methyl-pyrazol-3-yl)methylammonium
SMILES [?]:
Cn1c(c(cn1)Cl)C[NH3+]
InChi [?]:
InChI=1/C5H8ClN3/c1-9-5(2-7)4(6)3-8-9/h3H,2,7H2,1H3/p+1
InChi Info:
AuxInfo=1/1/N:1,8,5,4,3,7,9,6,2/rA:9nCNCCCNClCN+/rB:s1;s2;d3;s4;s2d5;s4;s3;s8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H9ClN3+
All Atoms:18
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:-34.2344
Area:293.211
Solvation:-41.5646
Coulombic:41.278
Bond Count [?]
All:9
Single:7
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:146.598
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.27
LogP (Chemaxon):-0.28

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Descriptor Annotations

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