Chemical ID: 4703508

COC(=O)C(=NO)C(=O)OC
Chemical ID:
4703508
Name [?]:
dimethyl 2-hydroxyiminopropanedioate
SMILES [?]:
COC(=O)C(=NO)C(=O)OC
InChi [?]:
InChI=1/C5H7NO5/c1-10-4(7)3(6-9)5(8)11-2/h9H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,5,3,8,6,4,9,7,2,10/E:(1,2)(4,5)(7,8)(10,11)/rA:11nCOCOCNOCOOC/rB:s1;s2;d3;s3;d5;s6;s5;d8;s8;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H7NO5
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:4.55961
Area:318.229
Solvation:-3.39612
Coulombic:-51.8973
Bond Count [?]
All:10
Single:7
Double:3
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:161.113
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:0.39
LogP (Chemaxon):0.26

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Descriptor Annotations

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