Chemical ID: 5069957

CC(c1cc2ccccc2o1)N
Chemical ID:
5069957
Name [?]:
1-benzofuran-2-ylethanamine
SMILES [?]:
CC(c1cc2ccccc2o1)N
InChi [?]:
InChI=1/C10H11NO/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-7H,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,6,9,4,2,5,10,3,12,11/rA:12cCCCCCCCCCCON/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;s3s10;s2;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11NO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:5.94168
Area:325.468
Solvation:-2.19502
Coulombic:-20.1678
Bond Count [?]
All:13
Single:9
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:161.2
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.72
LogP (Chemaxon):1.92

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