Home Halogens 1-bromo-4-[(2-chloroethyl)sulfanyl]benzene

1-bromo-4-[(2-chloroethyl)sulfanyl]benzene

CAS No.:
16181-14-9
Catalog Number:
AG01AIE2
Molecular Formula:
C8H8BrClS
Molecular Weight:
251.5711
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Product Description
Catalog Number:
AG01AIE2
Chemical Name:
1-bromo-4-[(2-chloroethyl)sulfanyl]benzene
CAS Number:
16181-14-9
Molecular Formula:
C8H8BrClS
Molecular Weight:
251.5711
MDL Number:
MFCD11641761
IUPAC Name:
1-bromo-4-(2-chloroethylsulfanyl)benzene
InChI:
InChI=1S/C8H8BrClS/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,5-6H2
InChI Key:
IFFUHWBFQAXYSI-UHFFFAOYSA-N
SMILES:
ClCCSc1ccc(cc1)Br
NSC Number:
202560
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.922g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.566g/mol
Monoisotopic Mass:
249.922g/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