CAS: 15771-06-9
이름: 2-(hydroxymethyl)-5-phenylmethoxypyran-4-one
SMILES:
C1=CC=C(C=C1)COC2=COC(=CC2=O)COMolecular Processing
Molecular formula
C13H12O4
Molecular weight
232.23
Exact mass
232.0736
XLogP
1.71
TPSA
59.67
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
61.67
Supplementary Information
InChIKey: ZGEXYNBHYVEWKT-UHFFFAOYSA-N
동의어
5-(benzyloxy)-2-(hydroxymethyl)-4H-pyran-4-one15771-06-9DTXSID50358528RefChem:300222DTXCID80309583858-430-74H-Pyran-4-one, 2-(hydroxymethyl)-5-(phenylmethoxy)-2-(hydroxymethyl)-5-phenylmethoxypyran-4-oneMFCD019275965-benzyloxy-2-hydroxymethyl-4h-pyran-4-one5-benzyloxy-2-(hydroxymethyl)pyran-4-one2-(hydroxymethyl)-5-(phenylmethoxy)-4h-pyran-4-one5-benzyloxy-2-hydroxymethyl-4-oxo-4H-pyranOprea1_285732MLS000539166CHEMBL450223SCHEMBL2116925ZGEXYNBHYVEWKT-UHFFFAOYSA-NHMS2364C20SBB0979185-Benzyloxy-2-Hydroxymethyl-4-PyroneAKOS005072413ED-00405-Benzyloxy-2-hydroxymethyl-pyran-4-oneSMR000163932SY108023CS-00368945-benzyloxy-2-(hydroxymethyl)-4H-pyran-4-oneEN300-1004292-(hydroxymethyl)-5-(phenylmethoxy)pyran-4-one
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