Chemical ID: 6681458

CC(C)COC(=O)C(=C)C
Chemical ID:
6681458
Name [?]:
isobutyl 2-methylprop-2-enoate
SMILES [?]:
CC(C)COC(=O)C(=C)C
InChi [?]:
InChI=1/C8H14O2/c1-6(2)5-10-8(9)7(3)4/h6H,3,5H2,1-2,4H3
InChi Info:
AuxInfo=1/0/N:1,3,9,10,4,2,8,6,7,5/E:(1,2)/rA:10nCCCCOCOCCC/rB:s1;s2;s2;s4;s5;d6;s6;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14O2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:7.01003
Area:327.961
Solvation:-1.189
Coulombic:-21.4524
Bond Count [?]
All:9
Single:7
Double:2
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:142.196
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.75
LogP (Chemaxon):2.11

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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