Chemical ID: 7131868

c1ccc2c(c1)[nH]c([nH+]2)C3CC3
Chemical ID:
7131868
Name [?]:
2-cyclopropyl-1,3-dihydrobenzoimidazole
SMILES [?]:
c1ccc2c(c1)[nH]c([nH+]2)C3CC3
InChi [?]:
InChI=1/C10H10N2/c1-2-4-9-8(3-1)11-10(12-9)7-5-6-7/h1-4,7H,5-6H2,(H,11,12)/p+1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,11,12,10,5,4,8,7,9/E:(1,2)(3,4)(5,6)(8,9)(11,12)/rA:12nCCCCCCNCN+CCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s4d8;s8;s10;s10s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11N2+
All Atoms:23
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:-21.7132
Area:321.372
Solvation:-29.7475
Coulombic:-8.24335
Bond Count [?]
All:14
Single:10
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:159.208
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.92
LogP (Chemaxon):2.52

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue