Home Halogens 1-[(2-bromoethyl)sulfanyl]-2,4-difluorobenzene

1-[(2-bromoethyl)sulfanyl]-2,4-difluorobenzene

CAS No.:
1097824-30-0
Catalog Number:
AG01B59K
Molecular Formula:
C8H7BrF2S
Molecular Weight:
253.1070
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Product Description
Catalog Number:
AG01B59K
Chemical Name:
1-[(2-bromoethyl)sulfanyl]-2,4-difluorobenzene
CAS Number:
1097824-30-0
Molecular Formula:
C8H7BrF2S
Molecular Weight:
253.1070
MDL Number:
MFCD11642596
IUPAC Name:
1-(2-bromoethylsulfanyl)-2,4-difluorobenzene
InChI:
InChI=1S/C8H7BrF2S/c9-3-4-12-8-2-1-6(10)5-7(8)11/h1-2,5H,3-4H2
InChI Key:
NHVQKUCIRCYMTB-UHFFFAOYSA-N
SMILES:
BrCCSc1ccc(cc1F)F
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.942g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.105g/mol
Monoisotopic Mass:
251.942g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties