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Home > Imidazoles > 929975-77-9
929975-77-9 | 1-(2-methoxyethyl)-4,5-dimethyl-1H-imidazole-2-thiol
CAS No: 929975-77-9 Catalog No: AG019KHZ MDL No:MFCD09040482
Product Description
Catalog Number:
AG019KHZ
Chemical Name:
1-(2-methoxyethyl)-4,5-dimethyl-1H-imidazole-2-thiol
CAS Number:
929975-77-9
Molecular Formula:
C8H14N2OS
Molecular Weight:
186.2746
MDL Number:
MFCD09040482
IUPAC Name:
3-(2-methoxyethyl)-4,5-dimethyl-1H-imidazole-2-thione
InChI:
InChI=1S/C8H14N2OS/c1-6-7(2)10(4-5-11-3)8(12)9-6/h4-5H2,1-3H3,(H,9,12)
InChI Key:
JRNKBUOPMTXWET-UHFFFAOYSA-N
SMILES:
COCCn1c(S)nc(c1C)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.083g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.273g/mol
Monoisotopic Mass:
186.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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