CCOC(=O)C(CCCl)Cl
CAS: 77100-87-9
Nombre: ethyl 2,4-dichlorobutanoate
SMILES: CCOC(=O)C(CCCl)Cl

Molecular Processing

Molecular formula
C6H10Cl2O2
Molecular weight
185.05
Exact mass
184.0058
XLogP
1.79
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
41.61

Supplementary Information

InChIKey: VCZDPMGQJBHJQA-UHFFFAOYSA-N
Sinónimos
Ethyl 2,4-dichlorobutanoate77100-87-9ethyl 2,4-dichlorbutyrateEthyl2,4-dichlorobutanoateSCHEMBL6560711DTXSID70504383VCZDPMGQJBHJQA-UHFFFAOYSA-N2,4-dichlorobutyric acid ethyl ester
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