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Chemical ID: 7093839
Chemical ID:
7093839
Name [?]:
4-(2-aminoethyl)-N,N-dimethyl-aniline
SMILES [?]:
CN(C)c1ccc(cc1)CCN
InChi [?]:
InChI=1/C10H16N2/c1-12(2)10-5-3-9(4-6-10)7-8-11/h3-6H,7-8,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,6,8,5,9,10,11,7,4,12,2/E:(1,2)(3,4)(5,6)/rA:12nCNCCCCCCCCCN/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H16N2 |
All Atoms: | 28 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.42349 |
Area: | 353.156 |
Solvation: | -1.4054 |
Coulombic: | -19.4732 |
Bond Count [?]
All: | 12 |
Single: | 9 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 164.248 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 1.51 |
LogP (Chemaxon): | 1.68 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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