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76541-52-1

76541-52-1 | 1H-Imidazole-1-sulfinyl chloride

CAS No: 76541-52-1 Catalog No: AG005B2E MDL No:

Product Description

Catalog Number:
AG005B2E
Chemical Name:
1H-Imidazole-1-sulfinyl chloride
CAS Number:
76541-52-1
Molecular Formula:
C3H3ClN2OS
Molecular Weight:
150.5867
IUPAC Name:
imidazole-1-sulfinyl chloride
InChI:
InChI=1S/C3H3ClN2OS/c4-8(7)6-2-1-5-3-6/h1-3H
InChI Key:
PKLCVRCOVYAZKN-UHFFFAOYSA-N
SMILES:
ClS(=O)n1cncc1

Properties

Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.965g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.58g/mol
Monoisotopic Mass:
149.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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