ChemDB: Chemical Search
Download
Chemical ID: 6048268
Chemical ID:
6048268
Name [?]:
3-(2-hydroxyphenyl)propanamide
SMILES [?]:
c1ccc(c(c1)CCC(=O)N)O
InChi [?]:
InChI=1/C9H11NO2/c10-9(12)6-5-7-3-1-2-4-8(7)11/h1-4,11H,5-6H2,(H2,10,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,8,5,4,9,11,12,10/rA:12nCCCCCCCCCONO/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s4;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H11NO2 |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.59677 |
Area: | 336.689 |
Solvation: | -2.82045 |
Coulombic: | -40.9647 |
Bond Count [?]
All: | 12 |
Single: | 8 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 165.189 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 3 |
XLogP: | 0.48 |
LogP (Chemaxon): | 0.92 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|