Chemical ID: 4728919

CC1C2CC(C1(C)C)CC2=O
Chemical ID:
4728919
Name [?]:
5,5,6-trimethylnorbornan-2-one
SMILES [?]:
CC1C2CC(C1(C)C)CC2=O
InChi [?]:
InChI=1/C10H16O/c1-6-8-4-7(5-9(8)11)10(6,2)3/h6-8H,4-5H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,7,8,4,9,2,5,3,10,6,11/E:(2,3)/rA:11cCCCCCCCCCCO/rB:s1;s2;s3;s4;s2s5;s6;s6;s5;s3s9;d10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H16O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:3
ZAP Information [?]
Total:6.02508
Area:301.055
Solvation:-1.5013
Coulombic:-7.98669
Bond Count [?]
All:12
Single:11
Double:1
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:152.233
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.43
LogP (Chemaxon):2.61

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Experimental Annotations

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Descriptor Annotations

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