Chemical ID: 4999565

CCOC(=O)CCN1CCCC1
Chemical ID:
4999565
Name [?]:
ethyl 3-pyrrolidin-1-ylpropanoate
SMILES [?]:
CCOC(=O)CCN1CCCC1
InChi [?]:
InChI=1/C9H17NO2/c1-2-12-9(11)5-8-10-6-3-4-7-10/h2-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,10,11,6,9,12,7,4,8,5,3/E:(3,4)(6,7)/rA:12nCCOCOCCNCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s10;s8s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H17NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.21482
Area:361.431
Solvation:-1.82096
Coulombic:-22.8034
Bond Count [?]
All:12
Single:11
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:171.237
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.85
LogP (Chemaxon):0.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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