COC1=CC(=CC(=C1OC)OC)C(=O)Cl
CAS: 4521-61-3
Nombre: 3,4,5-trimethoxybenzoyl chloride
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)Cl

Molecular Processing

Molecular formula
C10H11ClO4
Molecular weight
230.65
Exact mass
230.0346
XLogP
2.09
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
56.28

Supplementary Information

InChIKey: BUHYMJLFRZAFBF-UHFFFAOYSA-N
Sinónimos
3,4,5-Trimethoxybenzoyl chloride4521-61-3Benzoyl chloride, 3,4,5-trimethoxy-EINECS 224-851-4NSC 91023DTXSID2063507RefChem:118771DTXCID4040391224-851-4BUHYMJLFRZAFBF-UHFFFAOYSA-NTrimethylgalloyl chlorideTri-O-methylgalloyl chlorideMFCD000006753,4,5-TrimethoxybenzoylchlorideNSC-910233,4,5-Trimethoxybenzoic acid chloride3,4,5-Trimethoxybenzoic Acid Chloride; NSC 91023; Tri-O-methylgalloyl Chloride; Trimethylgalloyl ChlorideTroxipide Impurity 2GHU78X3G8UNCIOpen2_005468SCHEMBL2190963,5-Trimethoxybenzoyl chloride3,4,5-trimethoxy-benzoylchloride3,4,5-trimethoxybenzoyl-chlorideBenzoyl chloride,4,5-trimethoxy-3,4,5-trimethoxy benzoyl chloride3,4,5-trimethoxy-benzoyl chlorideEAA52161NSC91023BBL011386
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