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Rifapentine Impurity 4

CAT: 1299-RM-R091604-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-R091604-01Size:10 mg
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CAS Number
30651-60-6
Synonyms
Piperazin-1-amine
Molecular Formula
C4H11N3
Molecular Weight
101.15
Target Alternative Name
Rifapentine
Product Name Synonym
Piperazin-1-amine

Chemical Information

1-Aminopiperazine
CAS Number30651-60-6
PubChem CID147392
IUPAC Namepiperazin-1-amine
Molecular FormulaC4H11N3
Molecular Weight101.15
XLogP-1.1
Topological Polar Surface Area41.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity48
SMILES
C1CN(CCN1)N
InChI
InChI=1S/C4H11N3/c5-7-3-1-6-2-4-7/h6H,1-5H2
InChIKey
IYPZRUYMFDWKSS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Aminopiperazine
CAS: 30651-60-6
CID: 147392
Formula: C4H11N3
MW: 101.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight101.15
XLogP3-1.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass101.095297364
Monoisotopic Mass101.095297364
Topological Polar Surface Area41.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity48.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes