CAS: 628732-08-1
الاسم: methyl 6-bromo-3-oxo-1,2-dihydroindene-2-carboxylate
SMILES:
COC(=O)C1CC2=C(C1=O)C=CC(=C2)BrMolecular Processing
Molecular formula
C11H9BrO3
Molecular weight
269.09
Exact mass
267.9735
XLogP
1.98
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
57.68
Supplementary Information
InChIKey: HJYFQVWOJMRKDU-UHFFFAOYSA-N
مرادفات
628732-08-1Methyl 5-bromo-2,3-dihydro-1-oxo-1H-indene-2-carboxylateRefChem:3559975-bromo-1-oxoindan-2-carboxylic acid methyl esterMETHYL 5-BROMO-1-OXO-2,3-DIHYDRO-1H-INDENE-2-CARBOXYLATE1H-Indene-2-carboxylic acid, 5-bromo-2,3-dihydro-1-oxo-, methyl estermethyl 6-bromo-3-oxo-1,2-dihydroindene-2-carboxylateSCHEMBL1338969SCHEMBL29476744HJYFQVWOJMRKDU-UHFFFAOYSA-NDTXSID601199048AKOS020275189EN300-11270475-bromo-1-oxo-indan-2-carboxylic acid methyl esterZ1470494985METHYL5-BROMO-1-OXO-2,3-DIHYDRO-1H-INDENE-2-CARBOXYLATE
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