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144450-51-1 | Benzenethiol, 3,5-dibromo-
CAS No: 144450-51-1 Catalog No: AG001JKL MDL No:MFCD20233279
Product Description
Catalog Number:
AG001JKL
Chemical Name:
Benzenethiol, 3,5-dibromo-
CAS Number:
144450-51-1
Molecular Formula:
C6H4Br2S
Molecular Weight:
267.9690
MDL Number:
MFCD20233279
IUPAC Name:
3,5-dibromobenzenethiol
InChI:
InChI=1S/C6H4Br2S/c7-4-1-5(8)3-6(9)2-4/h1-3,9H
InChI Key:
AZVGHTVANGAGFT-UHFFFAOYSA-N
SMILES:
Sc1cc(Br)cc(c1)Br
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.838g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.966g/mol
Monoisotopic Mass:
265.84g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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