(4-(2-Bromoethyl)phenyl)(methyl)sulfane

Name: (4-(2-Bromoethyl)phenyl)(methyl)sulfane
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CAS No. 613233-75-3
Cat. No. CS-0524965
Molecule weight231.15
Purity≥98%
MDL No.None

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(4-(2-Bromoethyl)phenyl)(methyl)sulfane|CS-0524965

Structure of 613233-75-3

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General Information

CAS No. 613233-75-3
Cat. No. CS-0524965
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₁BrS
Molecular Weight 231.15
Synonym(s) 1-(2-Bromoethyl)-4-methylsulfanylbenzene
SMILES CSC1=CC=C(CCBr)C=C1

Synthesis

Route1
- 81227-89-6
- ~92%
- 613233-75-3
References
- Sankyo Company, Limited Patent: EP1632488 A1, 2006 ; Location in patent: Referential example 7 ;
Route2
- In-stock
  
  16188-55-9
- ~%
- 613233-75-3
References
- Avery, Mitchell A.; Muraleedharan, Kannoth M.; Desai, Prashant V.; Bandyopadhyaya, Achintya K.; Furtado, Marise M.; Tekwani, Babu L. Journal of Medicinal Chemistry, 2003 , vol. 46, # 20 p. 4244 - 4258

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 0
LogP 3.3459
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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(4-(2-Bromoethyl)phenyl)(methyl)sulfane

CAS No. 613233-75-3

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