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1216890-90-2 | 3-Oxopiperazine-1-carboximidamide hydroiodide
CAS No: 1216890-90-2 Catalog No: AG01FA9D MDL No:
Product Description
Catalog Number:
AG01FA9D
Chemical Name:
3-Oxopiperazine-1-carboximidamide hydroiodide
CAS Number:
1216890-90-2
Molecular Formula:
C5H11IN4O
Molecular Weight:
270.0715
IUPAC Name:
3-oxopiperazine-1-carboximidamide;hydroiodide
InChI:
InChI=1S/C5H10N4O.HI/c6-5(7)9-2-1-8-4(10)3-9;/h1-3H2,(H3,6,7)(H,8,10);1H
InChI Key:
SMPHLTWXVZRKKV-UHFFFAOYSA-N
SMILES:
O=C1NCCN(C1)C(=N)N.I
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.998g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
270.074g/mol
Monoisotopic Mass:
269.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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