Chemical ID: 4727908

Cc1cc(cc(c1O)C)CN(C)C
Chemical ID:
4727908
Name [?]:
4-(dimethylaminomethyl)-2,6-dimethyl-phenol
SMILES [?]:
Cc1cc(cc(c1O)C)CN(C)C
InChi [?]:
InChI=1/C11H17NO/c1-8-5-10(7-12(3)4)6-9(2)11(8)13/h5-6,13H,7H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,9,12,13,3,5,10,2,6,4,7,11,8/E:(1,2)(3,4)(5,6)(8,9)/rA:13nCCCCCCCOCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s4;s10;s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17NO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.08113
Area:360.16
Solvation:-1.92287
Coulombic:-21.7318
Bond Count [?]
All:13
Single:10
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:179.259
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.82
LogP (Chemaxon):2.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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