Chemical ID: 6681768

C=CC(=C)Cl
Chemical ID:
6681768
Name [?]:
2-chlorobuta-1,3-diene
SMILES [?]:
C=CC(=C)Cl
InChi [?]:
InChI=1/C4H5Cl/c1-3-4(2)5/h3H,1-2H2
InChi Info:
AuxInfo=1/0/N:1,4,2,3,5/rA:5nCCCCCl/rB:d1;s2;d3;s3;/rC:;;;;;

Chemical Details

Atom Count
Formula:C4H5Cl
All Atoms:5
Heavy Atoms:5
Chiral Atoms:0
ZAP Information [?]
Total:5.41396
Area:231.121
Solvation:-0.364058
Coulombic:-3.18706
Bond Count [?]
All:4
Single:2
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:88.5352
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.65
LogP (Chemaxon):1.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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