Chemical ID: 4121255

Cc1ccc(cc1N(C)C)N
Chemical ID:
4121255
Name [?]:
N',N',4-trimethylbenzene-1,3-diamine
SMILES [?]:
Cc1ccc(cc1N(C)C)N
InChi [?]:
InChI=1/C9H14N2/c1-7-4-5-8(10)6-9(7)11(2)3/h4-6H,10H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,9,10,3,4,6,2,5,7,11,8/E:(2,3)/rA:11nCCCCCCCNCCN/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s8;s5;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H14N2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.61142
Area:317.111
Solvation:-1.31635
Coulombic:-23.0597
Bond Count [?]
All:11
Single:8
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:150.221
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.64
LogP (Chemaxon):1.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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