CAS: 6261-22-9
Название: pent-2-yn-1-ol
SMILES:
CCC#CCOMolecular Processing
Molecular formula
C5H8O
Molecular weight
84.12
Exact mass
84.0575
XLogP
0.39
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
25.15
Supplementary Information
InChIKey: WLPYSOCRPHTIDZ-UHFFFAOYSA-N
Синонимы
2-Pentyn-1-olpent-2-yn-1-olEINECS 228-411-2AI3-37254DTXSID0064177RefChem:89000DTXCID4043430228-411-2InChI=1/C5H8O/c1-2-3-4-5-6/h6H,2,5H2,1HWLPYSOCRPHTIDZ-UHFFFAOYSA-N6261-22-92-pentynol2-Pentyne-1-olMFCD000409152-Pentynyl alcohol2-Pentyn-1-ol, 98%A2E2Y3AQD6SCHEMBL27078SCHEMBL83896SCHEMBL127175SCHEMBL271929SCHEMBL3358097SCHEMBL7366048ALBB-031790SBB009120AKOS015837601LS-11579SY048461DB-073158CS-0143646
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