CAS: 863672-29-1
이름: 5-morpholin-4-ylpent-3-yn-2-one
SMILES:
CC(=O)C#CCN1CCOCC1Molecular Processing
Molecular formula
C9H13NO2
Molecular weight
167.21
Exact mass
167.0946
XLogP
-0.09
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
45.72
Supplementary Information
InChIKey: NNINYAQXYABNGY-UHFFFAOYSA-N
동의어
863672-29-15-(Morpholin-4-yl)pent-3-yn-2-one5-Morpholinopent-3-yn-2-oneSCHEMBL2593159DTXSID90737313NNINYAQXYABNGY-UHFFFAOYSA-N5-(4-morpholinyl)-3-pentyn-2-oneMFCD204849215-Morpholin-4-yl-pent-3-yn-2-oneSY495326
18개 반응에 참여→