Chemical ID: 4167495

CCOC(=N)CC(=O)OCC
Chemical ID:
4167495
Name [?]:
ethyl 3-ethoxy-3-imino-propanoate
SMILES [?]:
CCOC(=N)CC(=O)OCC
InChi [?]:
InChI=1/C7H13NO3/c1-3-10-6(8)5-7(9)11-4-2/h8H,3-5H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,2,10,6,4,7,5,8,3,9/rA:11nCCOCNCCOOCC/rB:s1;s2;s3;w4;s4;s6;d7;s7;s9;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H13NO3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.39708
Area:346.502
Solvation:-3.26548
Coulombic:-35.9094
Bond Count [?]
All:10
Single:8
Double:2
Rotors:6
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:159.183
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.02
LogP (Chemaxon):0.51

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Descriptor Annotations

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