Chemical ID: 5107559

CCOC(=O)CC(C)N1CC1
Chemical ID:
5107559
Name [?]:
ethyl 3-aziridin-1-ylbutanoate
SMILES [?]:
CCOC(=O)CC(C)N1CC1
InChi [?]:
InChI=1/C8H15NO2/c1-3-11-8(10)6-7(2)9-4-5-9/h7H,3-6H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,2,10,11,6,7,4,9,5,3/E:(4,5)/rA:11cCCOCOCCCNCC/rB:s1;s2;s3;d4;s4;s6;s7;s7;s9;s9s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H15NO2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:5.93231
Area:336.738
Solvation:-2.48615
Coulombic:-21.9299
Bond Count [?]
All:11
Single:10
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:157.21
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.6
LogP (Chemaxon):0.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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