ChemDB: Chemical Search
Download
Chemical ID: 6686003
Chemical ID:
6686003
Name [?]:
2,6-diisopropyl-N,N-dimethyl-aniline
SMILES [?]:
CC(C)c1cccc(c1N(C)C)C(C)C
InChi [?]:
InChI=1/C14H23N/c1-10(2)12-8-7-9-13(11(3)4)14(12)15(5)6/h7-11H,1-6H3
InChi Info:
AuxInfo=1/0/N:1,3,14,15,11,12,6,5,7,2,13,4,8,9,10/E:(1,2,3,4)(5,6)(8,9)(10,11)(12,13)/rA:15nCCCCCCCCCNCCCCC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;s10;s10;s8;s13;s13;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H23N |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.58951 |
Area: | 385.935 |
Solvation: | -1.05886 |
Coulombic: | -8.82032 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 205.339 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 4.62 |
LogP (Chemaxon): | 4.7 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|