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2D Structure
Also known as: 29086-41-7, 1,1-bis-(bromomethyl)-cyclopropane, Cyclopropane, 1,1-bis(bromomethyl)-, Mfcd18836655, Ec 805-270-0, Schembl3659642
Molecular Formula
C5H8Br2
Molecular Weight
227.92  g/mol
InChI Key
GJCHFNVRRQTXHL-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1,1-bis(bromomethyl)cyclopropane
2.1.2 InChI
InChI=1S/C5H8Br2/c6-3-5(4-7)1-2-5/h1-4H2
2.1.3 InChI Key
GJCHFNVRRQTXHL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1(CBr)CBr
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 29086-41-7

2. 1,1-bis-(bromomethyl)-cyclopropane

3. Cyclopropane, 1,1-bis(bromomethyl)-

4. Mfcd18836655

5. Ec 805-270-0

6. Schembl3659642

7. Dtxsid90452195

8. 1,1-bis-(bromomethyl) Cyclopropane

9. Akos016005789

10. Zinc100043788

11. Ds-15112

12. Sy105835

13. 1,1-bis(bromomethyl)-cyclopropane

14. Db-102853

15. Cs-0088398

16. Ft-0696705

17. A876531

18. F8888-3780

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 227.92 g/mol
Molecular Formula C5H8Br2
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass227.89723 g/mol
Monoisotopic Mass225.89928 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count7
Formal Charge0
Complexity60.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1