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1217862-55-9 | 2-(4-Iodo-1H-pyrazol-1-yl)acetamide
CAS No: 1217862-55-9 Catalog No: AG00HGFP MDL No:MFCD15146429
Product Description
Catalog Number:
AG00HGFP
Chemical Name:
2-(4-Iodo-1H-pyrazol-1-yl)acetamide
CAS Number:
1217862-55-9
Molecular Formula:
C5H6IN3O
Molecular Weight:
251.0251
MDL Number:
MFCD15146429
IUPAC Name:
2-(4-iodopyrazol-1-yl)acetamide
InChI:
InChI=1S/C5H6IN3O/c6-4-1-8-9(2-4)3-5(7)10/h1-2H,3H2,(H2,7,10)
InChI Key:
WVYADYRFWCBASA-UHFFFAOYSA-N
SMILES:
NC(=O)Cn1cc(cn1)I
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.956g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.027g/mol
Monoisotopic Mass:
250.956g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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