CAS: 37365-71-2
이름: 3-methylbut-1-yn-1-ol
SMILES:
CC(C)C#COMolecular Processing
Molecular formula
C5H8O
Molecular weight
84.12
Exact mass
84.0575
XLogP
0.98
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
24.55
Supplementary Information
InChIKey: JQZGUQIEPRIDMR-UHFFFAOYSA-N
동의어
MethylbutynolButynol, methyl-DTXSID5068027RefChem:158148DTXCID40393183-Methyl butynol37365-71-23-methylbut-1-yn-1-ol3-methyl-1-butyn-1-ol99807-58-6SCHEMBL27077SCHEMBL1315446JQZGUQIEPRIDMR-UHFFFAOYSA-NAKOS015900538DA-23402
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