이름: 8-bromooct-6-yn-1-ol
SMILES:
C(CCC#CCBr)CCOMolecular Processing
Molecular formula
C8H13BrO
Molecular weight
205.09
Exact mass
204.015
XLogP
1.94
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
47.12
Supplementary Information
InChIKey: PARGSNVDFQXBFF-UHFFFAOYSA-N
동의어
8-bromo-6-octyn-1-olSCHEMBL11282823PARGSNVDFQXBFF-UHFFFAOYSA-N
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