Chemical ID: 5108110

CC=CC#CC=C1C=CC(=O)O1
Chemical ID:
5108110
Name [?]:
5-hex-4-en-2-ynylidenefuran-2-one
SMILES [?]:
CC=CC#CC=C1C=CC(=O)O1
InChi [?]:
InChI=1/C10H8O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h2-3,6-8H,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,4,5,6,8,9,7,10,11,12/rA:12nCCCCCCCCCCOO/rB:s1;w2;s3;t4;s5;w6;s7;d8;s9;d10;s7s10;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.80068
Area:355.192
Solvation:-2.07911
Coulombic:-19.1869
Bond Count [?]
All:12
Single:7
Double:4
Rotors:0
Chiral:2
Rigid Segments:1
Chemical Properties
Molecular Weight:160.169
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.55
LogP (Chemaxon):1.78

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Descriptor Annotations

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