Chemical ID: 6529783

CC(C)C(=O)OC
Chemical ID:
6529783
Name [?]:
methyl 2-methylpropanoate
SMILES [?]:
CC(C)C(=O)OC
InChi [?]:
InChI=1/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,7,2,4,5,6/E:(1,2)/rA:7nCCCCOOC/rB:s1;s2;s2;d4;s4;s6;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C5H10O2
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:4.95925
Area:256.805
Solvation:-1.46087
Coulombic:-18.4546
Bond Count [?]
All:6
Single:5
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:102.132
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.79
LogP (Chemaxon):1.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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