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Chemical ID: 4222059
Chemical ID:
4222059
Name [?]:
N-(2-methoxyphenyl)oxamide
SMILES [?]:
COc1ccccc1NC(=O)C(=O)N
InChi [?]:
InChI=1/C9H10N2O3/c1-14-7-5-3-2-4-6(7)11-9(13)8(10)12/h2-5H,1H3,(H2,10,12)(H,11,13)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,8,3,12,10,14,9,13,11,2/rA:14nCOCCCCCCNCOCON/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;d12;s12;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H10N2O3 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.22334 |
Area: | 360.909 |
Solvation: | -2.79938 |
Coulombic: | -58.2173 |
Bond Count [?]
All: | 14 |
Single: | 9 |
Double: | 5 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 194.187 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 5 |
XLogP: | -0.14 |
LogP (Chemaxon): | 0.18 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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