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Chemical ID: 4728677
Chemical ID:
4728677
Name [?]:
N-(3-acetyl-4-hydroxy-phenyl)acetamide
SMILES [?]:
CC(=O)c1cc(ccc1O)NC(=O)C
InChi [?]:
InChI=1/C10H11NO3/c1-6(12)9-5-8(11-7(2)13)3-4-10(9)14/h3-5,14H,1-2H3,(H,11,13)
InChi Info:
AuxInfo=1/1/N:1,14,7,8,5,2,12,6,4,9,11,3,13,10/rA:14nCCOCCCCCCONCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s9;s6;s11;d12;s12;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H11NO3 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 4.82305 |
Area: | 356.579 |
Solvation: | -4.09144 |
Coulombic: | -40.7695 |
Bond Count [?]
All: | 14 |
Single: | 9 |
Double: | 5 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 193.199 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 0.72 |
LogP (Chemaxon): | 1.05 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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