Chemical ID: 4260868

c1ccc(c(c1)C#N)N
Chemical ID:
4260868
Name [?]:
2-aminobenzonitrile
SMILES [?]:
c1ccc(c(c1)C#N)N
InChi [?]:
InChI=1/C7H6N2/c8-5-6-3-1-2-4-7(6)9/h1-4H,9H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,7,5,4,8,9/rA:9nCCCCCCCNN/rB:s1;d2;s3;d4;d1s5;s5;t7;s4;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6N2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:5.8697
Area:276.506
Solvation:-1.04294
Coulombic:-21.1583
Bond Count [?]
All:9
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:118.136
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.36
LogP (Chemaxon):1.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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