Chemical ID: 6684266

c1ccc2=c3ccccc3=c2c1
Chemical ID:
6684266
Name [?]:
biphenylene
SMILES [?]:
c1ccc2=c3ccccc3=c2c1
InChi [?]:
InChI=1/C12H8/c1-2-6-10-9(5-1)11-7-3-4-8-12(10)11/h1-8H
InChi Info:
AuxInfo=1/0/N:1,2,8,7,12,3,9,6,11,4,10,5/E:(1,2,3,4)(5,6,7,8)(9,10,11,12)/rA:12nCCCCCCCCCCCC/rB:s1;d2;s3;d4;s5;d6;s7;d8;s5s9;s4d10;d1s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H8
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.19247
Area:315.054
Solvation:-0.683884
Coulombic:-3.2707
Bond Count [?]
All:14
Single:8
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:152.192
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.88
LogP (Chemaxon):3.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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