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130412-47-4 | Phosphenothioic bromide (9CI)
CAS No: 130412-47-4 Catalog No: AG000UE6 MDL No:
Product Description
Catalog Number:
AG000UE6
Chemical Name:
Phosphenothioic bromide (9CI)
CAS Number:
130412-47-4
Molecular Formula:
BrHOPS
Molecular Weight:
159.9501
IUPAC Name:
bromo-oxo-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/BrOPS/c1-3(2)4
InChI Key:
GPWZVAJPFCRYBG-UHFFFAOYSA-N
SMILES:
BrP(=S)=O
Properties
Complexity:
62.4
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.859g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.937g/mol
Monoisotopic Mass:
157.859g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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