C1COC2=C(C1=O)C=CC(=C2)Br
CAS: 18442-22-3
Название: 7-bromo-2,3-dihydrochromen-4-one
SMILES: C1COC2=C(C1=O)C=CC(=C2)Br

Molecular Processing

Molecular formula
C9H7BrO2
Molecular weight
227.06
Exact mass
225.9629
XLogP
2.41
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.58

Supplementary Information

InChIKey: DMEAYYYHWLCPCD-UHFFFAOYSA-N
Синонимы
7-bromo-3,4-dihydro-2H-1-benzopyran-4-oneRefChem:545746830-935-77-Bromochroman-4-one18442-22-37-BROMO-4-CHROMANONE7-bromo-2,3-dihydrochromen-4-one7-bromo-chroman-4-oneMFCD097440557-bromo-2,3-dihydro-4H-chromen-4-one7-BROMO-2,3-DIHYDRO-4H-1-BENZOPYRAN-4-ONE7-bromo 4-chromanone7-bromochromane-4-one7-BROMOCHROMANONESCHEMBL2066249SCHEMBL29825555DTXSID50624912DMEAYYYHWLCPCD-UHFFFAOYSA-NAKOS015835864CS-W003633FS-2909MB07538AC-29165SY032002EN300-125942F077088Z1269239917
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