Chemical ID: 4625511

CC(C)(C)C1CCC(=O)CC1
Chemical ID:
4625511
Name [?]:
4-tert-butylcyclohexan-1-one
SMILES [?]:
CC(C)(C)C1CCC(=O)CC1
InChi [?]:
InChI=1/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,6,11,7,10,5,8,2,9/E:(1,2,3)(4,5)(6,7)/rA:11nCCCCCCCCOCC/rB:s1;s2;s2;s2;s5;s6;s7;d8;s8;s5s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H18O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.45
Area:318.918
Solvation:-1.52296
Coulombic:-8.02112
Bond Count [?]
All:11
Single:10
Double:1
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:154.249
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.11
LogP (Chemaxon):3.02

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Descriptor Annotations

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