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Chemical ID: 7101975
Chemical ID:
7101975
Name [?]:
N-(p-tolylmethyl)hexan-1-amine
SMILES [?]:
CCCCCCNCc1ccc(cc1)C
InChi [?]:
InChI=1/C14H23N/c1-3-4-5-6-11-15-12-14-9-7-13(2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,15,2,3,4,5,11,13,10,14,6,8,12,9,7/E:(7,8)(9,10)/rA:15nCCCCCCNCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H23N |
All Atoms: | 38 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.0788 |
Area: | 444.838 |
Solvation: | -1.04211 |
Coulombic: | -11.7903 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 205.339 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 4.46 |
LogP (Chemaxon): | 4.04 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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