Chemical ID: 5106771

CCOC(=O)CN(C)C(=O)OCC
Chemical ID:
5106771
Name [?]:
ethyl 2-(ethoxycarbonyl-methyl-amino)acetate
SMILES [?]:
CCOC(=O)CN(C)C(=O)OCC
InChi [?]:
InChI=1/C8H15NO4/c1-4-12-7(10)6-9(3)8(11)13-5-2/h4-6H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,13,8,2,12,6,4,9,7,5,10,3,11/rA:13nCCOCOCNCCOOCC/rB:s1;s2;s3;d4;s4;s6;s7;s7;d9;s9;s11;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H15NO4
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.94428
Area:384.722
Solvation:-2.67376
Coulombic:-47.3834
Bond Count [?]
All:12
Single:10
Double:2
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:189.209
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:0.57
LogP (Chemaxon):0.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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