CCOC(=O)CCCCCCCCC(C)Br
Nombre: ethyl 10-bromoundecanoate
SMILES: CCOC(=O)CCCCCCCCC(C)Br

Molecular Processing

Molecular formula
C13H25BrO2
Molecular weight
293.24
Exact mass
292.1038
XLogP
4.45
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
10
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
71.96

Supplementary Information

InChIKey: DASLZCOEVBGKPI-UHFFFAOYSA-N
Sinónimos
ethyl 10-bromoundecanoateNSC100214NCIOpen2_006678SCHEMBL2715956DASLZCOEVBGKPI-UHFFFAOYSA-NNSC-100214
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