C1CC(=O)C2=C1C=C(C=C2)Br
CAS: 34598-49-7
Name: 5-bromo-2,3-dihydroinden-1-one
SMILES: C1CC(=O)C2=C1C=C(C=C2)Br

Molecular Processing

Molecular formula
C9H7BrO
Molecular weight
211.06
Exact mass
209.968
XLogP
2.58
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
46.79

Supplementary Information

InChIKey: KSONICAHAPRCMV-UHFFFAOYSA-N
Synonyms
5-Bromo-1-indanone34598-49-7DTXSID40334432RefChem:532798DTXCID50285522629-357-65-Bromoindanone5-Bromo-2,3-dihydro-1H-inden-1-one5-bromoindan-1-one5-bromo-2,3-dihydroinden-1-one1H-Inden-1-one, 5-bromo-2,3-dihydro-MFCD000827181-Indanone, 5-bromo-5-bromo-indanone5-Bromo indanone5-bromo-1-oxoindane5-bromoindane-1-one5-bromo-indan-1-oneSCHEMBL270395-Bromo-1-indanone, 97%orb2940551CHEMBL3092387SCHEMBL31108080AC-172SBB054671TYD-00027AKOS000121932CS-W008687FS-1029PB48767
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Involved in 192 reactions→

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