Chemical ID: 5253979

CCN(CC)c1ccccc1N
Chemical ID:
5253979
Name [?]:
N,N-diethylbenzene-1,2-diamine
SMILES [?]:
CCN(CC)c1ccccc1N
InChi [?]:
InChI=1/C10H16N2/c1-3-12(4-2)10-8-6-5-7-9(10)11/h5-8H,3-4,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,9,8,10,7,11,6,12,3/E:(1,2)(3,4)/rA:12nCCNCCCCCCCCN/rB:s1;s2;s3;s4;s3;s6;d7;s8;d9;d6s10;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H16N2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.15393
Area:338.285
Solvation:-1.3032
Coulombic:-24.0159
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:2.26
LogP (Chemaxon):2.21

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Experimental Annotations

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Descriptor Annotations

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