CCCC1=C(C=CC(=C1O)C(=O)C)O
CAS: 40786-69-4
Name: 1-(2,4-dihydroxy-3-propylphenyl)ethanone
SMILES: CCCC1=C(C=CC(=C1O)C(=O)C)O

Molecular Processing

Molecular formula
C11H14O3
Molecular weight
194.23
Exact mass
194.0943
XLogP
2.25
TPSA
57.53
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
53.77

Supplementary Information

InChIKey: QGGRBWUQXAFYEC-UHFFFAOYSA-N
Synonyme
2',4'-DIHYDROXY-3'-PROPYLACETOPHENONERefChem:439424627-597-640786-69-41-(2,4-dihydroxy-3-propylphenyl)ethanone1-(2,4-Dihydroxy-3-propylphenyl)ethan-1-oneMFCD000686161-[2,4-dihydroxy-3-propylphenyl)ethanoneEthanone, 1-(2,4-dihydroxy-3-propylphenyl)-Ethanone,1-(2,4-dihydroxy-3-propylphenyl)-(2,4-Dihydroxy-3-n-propylphenyl)ethanone1-(2,4-dihydroxy-3-propyl-phenyl)ethanoneSCHEMBL480388SCHEMBL6932259SCHEMBL30736074DTXSID80379448QGGRBWUQXAFYEC-UHFFFAOYSA-NCS-M09272,4-di-hydroxy-3-propylacetophenone4-acetyl-3-hydroxy-2-propyl phenolAKOS000278485AC-90442',4'-dihydroxy-3'-propyl acetophenone2',4'-dihydroxy-3'-n-propylacetophenoneAS-31423SY106815DB-0496541-(2,4-dihydroxy-3-propylphenyl) ethanone1-(2,4-dihydroxy-3-propylphenyl)-ethanone3'-(n-Propyl)-2',4'-Dihydroxyacetophenone
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