1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 InChI

InChI=1S/C2H6S.BBr2/c1-3-2;2-1-3/h1-2H3;

2.1.2 InChI Key

REOJEHVVMRCCMX-UHFFFAOYSA-N

2.1.3 Canonical SMILES

[B](Br)Br.CSC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 55671-55-1

2. Dibromoboron;methylsulfanylmethane

3. Dibromoborane Dimethyl Sulfide (1m In Dichloromethane)

4. Boron Dibromide Methyl Sulfide Complex

5. Schembl1549136

6. Dtxsid50452212

7. Dibromoborane Methyl Sulfide Complex

8. (methylsulfanyl)methane; Dibromoboranyl

9. A50014

10. Dibromoborane Dimethyl Sulfide Complex Solution, 1.0 M In Methylene Chloride

11. Dibromoborane Dimethyl Sulfide Complex Solution (1.0 M In Methylene Chloride)

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₂H₆BBr₂S
Molecular Weight	232.76 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	232.86295 g/mol
Monoisotopic Mass	230.86500 g/mol
Topological Polar Surface Area	25.3 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	5.5
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

Dibromoborane Dimethyl Sulfide Complex