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1105190-20-2 | 2-[5-(Hydroxymethyl)-2-mercapto-1H-imidazol-1-yl]-N-methylacetamide
CAS No: 1105190-20-2 Catalog No: AG01ARVP MDL No:MFCD11986407
Product Description
Catalog Number:
AG01ARVP
Chemical Name:
2-[5-(Hydroxymethyl)-2-mercapto-1H-imidazol-1-yl]-N-methylacetamide
CAS Number:
1105190-20-2
MDL Number:
MFCD11986407
IUPAC Name:
2-[4-(hydroxymethyl)-2-sulfanylidene-1H-imidazol-3-yl]-N-methylacetamide
InChI:
InChI=1S/C7H11N3O2S/c1-8-6(12)3-10-5(4-11)2-9-7(10)13/h2,11H,3-4H2,1H3,(H,8,12)(H,9,13)
InChI Key:
ZZSYMFFRIWZCCV-UHFFFAOYSA-N
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.057g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.244g/mol
Monoisotopic Mass:
201.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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