C1OC2=C(O1)C=C(C=C2)C=C(Br)Br
CAS: 92449-54-2
Name: 5-(2,2-dibromoethenyl)-1,3-benzodioxole
SMILES: C1OC2=C(O1)C=C(C=C2)C=C(Br)Br

Molecular Processing

Molecular formula
C9H6Br2O2
Molecular weight
305.95
Exact mass
303.8735
XLogP
3.5
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
58.4

Supplementary Information

InChIKey: YRYRFIXIDMZLLK-UHFFFAOYSA-N
Synonyms
92449-54-2SCHEMBL861144YRYRFIXIDMZLLK-UHFFFAOYSA-N5-(2,2-dibromovinyl)-1,3-benzodioxolDB-1000295-(2,2-dibromo-vinyl)-benzo[1,3]dioxole
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Involved in 3 reactions→

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