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Chemical ID: 7512664
Chemical ID:
7512664
Name [?]:
N'-cyclooctyl-N,N-dimethyl-ethane-1,2-diamine
SMILES [?]:
CN(C)CCNC1CCCCCCC1
InChi [?]:
InChI=1/C12H26N2/c1-14(2)11-10-13-12-8-6-4-3-5-7-9-12/h12-13H,3-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,11,10,12,9,13,8,14,5,4,7,6,2/E:(1,2)(4,5)(6,7)(8,9)/rA:14nCNCCCNCCCCCCCC/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;s10;s11;s12;s7s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H26N2 |
All Atoms: | 40 |
Heavy Atoms: | 14 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.88667 |
Area: | 396.305 |
Solvation: | -1.02096 |
Coulombic: | -15.3875 |
Bond Count [?]
All: | 14 |
Single: | 14 |
Double: | 0 |
Rotors: | 4 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.64 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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