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Home > Imidazoles > 118950-67-7
118950-67-7 | 2-(BUTYLSULFANYL)-4,5-DIHYDRO-1H-IMIDAZOLE HYDROIODIDE
CAS No: 118950-67-7 Catalog No: AG01AQTU MDL No:MFCD16661049
Product Description
Catalog Number:
AG01AQTU
Chemical Name:
2-(BUTYLSULFANYL)-4,5-DIHYDRO-1H-IMIDAZOLE HYDROIODIDE
CAS Number:
118950-67-7
Molecular Formula:
C7H15IN2S
Molecular Weight:
286.1769
MDL Number:
MFCD16661049
IUPAC Name:
2-butylsulfanyl-4,5-dihydro-1H-imidazole;hydroiodide
InChI:
InChI=1S/C7H14N2S.HI/c1-2-3-6-10-7-8-4-5-9-7;/h2-6H2,1H3,(H,8,9);1H
InChI Key:
IQPVLKAMHVHSID-UHFFFAOYSA-N
SMILES:
CCCCSC1=NCCN1.I
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.175g/mol
Monoisotopic Mass:
286g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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