Chemical ID: 5039494

CCC1(OCCO1)CC
Chemical ID:
5039494
Name [?]:
2,2-diethyl-1,3-dioxolane
SMILES [?]:
CCC1(OCCO1)CC
InChi [?]:
InChI=1/C7H14O2/c1-3-7(4-2)8-5-6-9-7/h3-6H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,9,2,8,5,6,3,4,7/E:(1,2)(3,4)(5,6)(8,9)/rA:9nCCCOCCOCC/rB:s1;s2;s3;s4;s5;s3s6;s3;s8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H14O2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:4.88715
Area:282.203
Solvation:-2.16794
Coulombic:-17.451
Bond Count [?]
All:9
Single:9
Double:0
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:130.185
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.35
LogP (Chemaxon):1.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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