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Pyrroline

CAT: 1299-RG-A261340-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A261340-02Size:25 mg
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CAS Number
28350-87-0
Synonyms
2,3-dihydro-1H-pyrrole
Molecular Formula
C4H7N
Molecular Weight
69.11
Product Name Synonym
2,3-dihydro-1H-pyrrole

Chemical Information

Pyrroline

2-pyrroline is a pyrroline.

CAS Number28350-87-0
PubChem CID94395
IUPAC Name2,3-dihydro-1H-pyrrole
Molecular FormulaC4H7N
Molecular Weight69.11
XLogP0.8
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count5
Formal Charge0
Complexity47
SMILES
C1CNC=C1
InChI
InChI=1S/C4H7N/c1-2-4-5-3-1/h1,3,5H,2,4H2
InChIKey
RSEBUVRVKCANEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrroline
CAS: 28350-87-0
CID: 94395
Formula: C4H7N
MW: 69.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight69.11
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass69.057849228
Monoisotopic Mass69.057849228
Topological Polar Surface Area12 Ų
Heavy Atom Count5
Formal Charge0
Complexity47.6
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

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