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80533-87-5

80533-87-5 | Carbonobromidimidothioicacid (9CI)

CAS No: 80533-87-5 Catalog No: AG005KMV MDL No:

Product Description

Catalog Number:
AG005KMV
Chemical Name:
Carbonobromidimidothioicacid (9CI)
CAS Number:
80533-87-5
Molecular Formula:
CH2BrNS
Molecular Weight:
140.0023
IUPAC Name:
carbamothioyl bromide
InChI:
InChI=1S/CH2BrNS/c2-1(3)4/h(H2,3,4)
InChI Key:
QCSSVVNIFNIDIM-UHFFFAOYSA-N
SMILES:
SC(=N)Br

Properties

Complexity:
35  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.909g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.998g/mol
Monoisotopic Mass:
138.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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