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24535-57-7 | Benzene, 1-bromo-4-[(4-chlorophenyl)thio]-
CAS No: 24535-57-7 Catalog No: AG002OH3 MDL No:MFCD22484518
Product Description
Catalog Number:
AG002OH3
Chemical Name:
Benzene, 1-bromo-4-[(4-chlorophenyl)thio]-
CAS Number:
24535-57-7
Molecular Formula:
C12H8BrClS
Molecular Weight:
299.6139
MDL Number:
MFCD22484518
IUPAC Name:
1-bromo-4-(4-chlorophenyl)sulfanylbenzene
InChI:
InChI=1S/C12H8BrClS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H
InChI Key:
BXTYODSDEPRLLJ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Sc1ccc(cc1)Br
NSC Number:
99889
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.922g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.61g/mol
Monoisotopic Mass:
297.922g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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