CAS: 442549-35-1
이름: ethyl 8-bromo-6-methoxy-4-oxochromene-2-carboxylate
SMILES:
CCOC(=O)C1=CC(=O)C2=C(O1)C(=CC(=C2)OC)BrMolecular Processing
Molecular formula
C13H11BrO5
Molecular weight
327.13
Exact mass
325.979
XLogP
2.74
TPSA
65.74
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
72.69
Supplementary Information
InChIKey: RCVPYVWCNLJBMO-UHFFFAOYSA-N
동의어
ethyl 8-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylate442549-35-1SCHEMBL4253257RCVPYVWCNLJBMO-UHFFFAOYSA-NDB-3195268-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylic acid ethyl ester
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