CCOC(=O)COCCCCBr
CAS: 54131-75-8
الاسم: ethyl 2-(4-bromobutoxy)acetate
SMILES: CCOC(=O)COCCCCBr

Molecular Processing

Molecular formula
C8H15BrO3
Molecular weight
239.11
Exact mass
238.0205
XLogP
1.74
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
50.48

Supplementary Information

InChIKey: AYDDHWOOPHEEMP-UHFFFAOYSA-N
مرادفات
54131-75-8ethyl 4-bromobutoxyacetateETHYL 2-(4-BROMOBUTOXY)ACETATEEthyl (4-bromobutoxy)acetateSCHEMBL5219102DTXSID80607117AYDDHWOOPHEEMP-UHFFFAOYSA-N(4-bromo-butoxy)-acetic acid ethyl esterDA-34500
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