Chemical ID: 6660042

CC(=O)OCC1CCCO1
Chemical ID:
6660042
Name [?]:
tetrahydrofuran-2-ylmethyl acetate
SMILES [?]:
CC(=O)OCC1CCCO1
InChi [?]:
InChI=1/C7H12O3/c1-6(8)10-5-7-3-2-4-9-7/h7H,2-5H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,7,9,5,2,6,3,10,4/rA:10cCCOOCCCCCO/rB:s1;d2;s2;s4;s5;s6;s7;s8;s6s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H12O3
All Atoms:10
Heavy Atoms:10
Chiral Atoms:1
ZAP Information [?]
Total:4.45914
Area:313.341
Solvation:-3.37439
Coulombic:-24.7509
Bond Count [?]
All:10
Single:9
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:144.168
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.59
LogP (Chemaxon):0.1

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Experimental Annotations

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Descriptor Annotations

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