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Chemical ID: 6155308
Chemical ID:
6155308
Name [?]:
2-ethoxy-N-(2-ethoxyphenyl)-acetamide
SMILES [?]:
CCOCC(=O)Nc1ccccc1OCC
InChi [?]:
InChI=1/C12H17NO3/c1-3-15-9-12(14)13-10-7-5-6-8-11(10)16-4-2/h5-8H,3-4,9H2,1-2H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,16,2,15,10,11,9,12,4,8,13,5,7,6,3,14/rA:16nCCOCCONCCCCCCOCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s13;s14;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H17NO3 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.95055 |
Area: | 429.405 |
Solvation: | -4.78457 |
Coulombic: | -36.2714 |
Bond Count [?]
All: | 16 |
Single: | 12 |
Double: | 4 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 223.268 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 1.52 |
LogP (Chemaxon): | 1.53 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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