Chemical ID: 5494915

Cc1cc(nc(n1)c2ccccc2)C
Chemical ID:
5494915
Name [?]:
4,6-dimethyl-2-phenyl-pyrimidine
SMILES [?]:
Cc1cc(nc(n1)c2ccccc2)C
InChi [?]:
InChI=1/C12H12N2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h3-8H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,11,10,12,9,13,3,2,4,8,6,7,5/E:(1,2)(4,5)(6,7)(9,10)(13,14)/rA:14nCCCCNCNCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;d8s12;s4;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H12N2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.79817
Area:364.758
Solvation:-1.32077
Coulombic:-12.0521
Bond Count [?]
All:15
Single:9
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:184.237
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.39
LogP (Chemaxon):2.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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