C1CC2=C(CC1=O)C=CC(=C2)Br
CAS: 4133-35-1
Name: 6-bromo-3,4-dihydro-1H-naphthalen-2-one
SMILES: C1CC2=C(CC1=O)C=CC(=C2)Br

Molecular Processing

Molecular formula
C10H9BrO
Molecular weight
225.08
Exact mass
223.9837
XLogP
2.51
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
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
2
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
51.17

Supplementary Information

InChIKey: BYHKDUFPSJWJDI-UHFFFAOYSA-N
Synonyme
6-Bromo-2-tetralone4133-35-1DTXSID70369939RefChem:104293DTXCID80320975640-168-86-Bromo-3,4-dihydro-2(1H)-naphthalenone6-bromo-3,4-dihydro-1H-naphthalen-2-one6-bromo-3,4-dihydronaphthalen-2(1H)-one6-bromotetralin-2-oneMFCD002393886-bromo-1,2,3,4-tetrahydronaphthalen-2-one6-bromo-beta-tetralone2(1H)-Naphthalenone, 6-bromo-3,4-dihydro-6-bromo 2-tetraloneSCHEMBL354022orb2940140CS-B0116TYD-00439AKOS015834801AB05455PS-77856-bromo-1,3,4-trihydronaphthalen-2-oneAC-24305HY-30059SY0130086-bromo-3,4-dihydro-2(1H)-napthalenoneDB-049740ST50405856EN300-71714
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