CCC(=O)C1=CC=C(C=C1)OCC(=O)OC
CAS: 105253-86-9
Nombre: methyl 2-(4-propanoylphenoxy)acetate
SMILES: CCC(=O)C1=CC=C(C=C1)OCC(=O)OC

Molecular Processing

Molecular formula
C12H14O4
Molecular weight
222.24
Exact mass
222.0892
XLogP
1.83
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
58.57

Supplementary Information

InChIKey: DTQJOWPTEIWZPX-UHFFFAOYSA-N
Sinónimos
105253-86-9methyl (4-propanoylphenoxy)acetateDTXSID20587929RefChem:353081DTXCID20538693methyl (4-propionylphenoxy)acetatemethyl 2-(4-propanoylphenoxy)acetateAcetic acid, [4-(1-oxopropyl)phenoxy]-, methyl esterMethyl 2-(4-propionylphenoxy)acetateMFCD09063134SCHEMBL7333688ALBB-026143Methyl2-(4-propionylphenoxy)acetateSBB072871STK665371AKOS000195992methyl 4-(2-methylacetyl)phenoxyacetateLS-08864ST4134746H35438Acetic acid, 2-[4-(1-oxopropyl)phenoxy]-, methyl ester
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