Chemical ID: 4730912

CCCc1ccccc1N
Chemical ID:
4730912
Name [?]:
2-propylaniline
SMILES [?]:
CCCc1ccccc1N
InChi [?]:
InChI=1/C9H13N/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7H,2,5,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,6,7,3,5,8,4,9,10/rA:10nCCCCCCCCCN/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H13N
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.90599
Area:305.427
Solvation:-0.729677
Coulombic:-18.4568
Bond Count [?]
All:10
Single:7
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:135.206
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.46
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