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479552-18-6

479552-18-6 | 1H-Imidazole-5-sulfonyl chloride, 1-methyl-

CAS No: 479552-18-6 Catalog No: AG00DKTC MDL No:MFCD03094628

Product Description

Catalog Number:
AG00DKTC
Chemical Name:
1H-Imidazole-5-sulfonyl chloride, 1-methyl-
CAS Number:
479552-18-6
Molecular Formula:
C4H5ClN2O2S
Molecular Weight:
180.6127
MDL Number:
MFCD03094628
IUPAC Name:
3-methylimidazole-4-sulfonyl chloride
InChI:
InChI=1S/C4H5ClN2O2S/c1-7-3-6-2-4(7)10(5,8)9/h2-3H,1H3
InChI Key:
IUCGUPGXVCRGRV-UHFFFAOYSA-N
SMILES:
Cn1cncc1S(=O)(=O)Cl

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.976g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.606g/mol
Monoisotopic Mass:
179.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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