Chemical ID: 4831450

C1CCCCCC(CCCCC1)NCCN
Chemical ID:
4831450
Name [?]:
N-cyclododecylethane-1,2-diamine
SMILES [?]:
C1CCCCCC(CCCCC1)NCCN
InChi [?]:
InChI=1/C14H30N2/c15-12-13-16-14-10-8-6-4-2-1-3-5-7-9-11-14/h14,16H,1-13,15H2
InChi Info:
AuxInfo=1/0/N:1,2,12,3,11,4,10,5,9,6,8,15,14,7,16,13/E:(2,3)(4,5)(6,7)(8,9)(10,11)/rA:16nCCCCCCCCCCCCNCCN/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s1s11;s7;s13;s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H30N2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.80958
Area:428.78
Solvation:-0.90991
Coulombic:-23.7413
Bond Count [?]
All:16
Single:16
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:226.401
H-Bond Donors:3
H-Bond Acceptors:2
XLogP:4.29
LogP (Chemaxon):2.97

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Descriptor Annotations

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