Chemical ID: 6694783

Cc1csc(n1)C(C)C
Chemical ID:
6694783
Name [?]:
2-isopropyl-4-methyl-thiazole
SMILES [?]:
Cc1csc(n1)C(C)C
InChi [?]:
InChI=1/C7H11NS/c1-5(2)7-8-6(3)4-9-7/h4-5H,1-3H3
InChi Info:
AuxInfo=1/0/N:8,9,1,3,7,2,5,6,4/E:(1,2)/rA:9nCCCSCNCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;s7;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H11NS
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:6.66236
Area:301.262
Solvation:-0.869176
Coulombic:-5.62737
Bond Count [?]
All:9
Single:7
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:141.235
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.55
LogP (Chemaxon):2.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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