Chemical ID: 6680824

CC1=C(C2(C1(C(=C2C)C)C)C)C
Chemical ID:
6680824
Name [?]:
1,2,3,4,5,6-hexamethylbicyclo[2.2.0]hexa-2,5-diene
SMILES [?]:
CC1=C(C2(C1(C(=C2C)C)C)C)C
InChi [?]:
InChI=1/C12H18/c1-7-8(2)12(6)10(4)9(3)11(7,12)5/h1-6H3
InChi Info:
AuxInfo=1/0/N:1,12,9,8,10,11,2,3,6,7,5,4/E:(1,2,3,4)(5,6)(7,8,9,10)(11,12)/rA:12nCCCCCCCCCCCC/rB:s1;d2;s3;s2s4;s5;s4d6;s7;s6;s5;s4;s3;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H18
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:8.3022
Area:343.33
Solvation:-0.281055
Coulombic:-2.30689
Bond Count [?]
All:13
Single:11
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:162.271
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.96
LogP (Chemaxon):2.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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