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3-Azido-1-Propene

CAT: 1596-AR-P32931-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P32931-01Size:10 Units
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CAS Number
821-13-6
Molecular Formula
C3H5N3
Molecular Weight
83.09
API Name
Propene

Chemical Information

1-Propene, 3-azido-
CAS Number821-13-6
PubChem CID533456
IUPAC Name3-azidoprop-1-ene
Molecular FormulaC3H5N3
Molecular Weight83.09
XLogP1.9
Topological Polar Surface Area14.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity80
SMILES
C=CCN=[N+]=[N-]
InChI
InChI=1S/C3H5N3/c1-2-3-5-6-4/h2H,1,3H2
InChIKey
VYZOFUACMOJPRL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Propene, 3-azido-
CAS: 821-13-6
CID: 533456
Formula: C3H5N3
MW: 83.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight83.09
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass83.048347172
Monoisotopic Mass83.048347172
Topological Polar Surface Area14.4 Ų
Heavy Atom Count6
Formal Charge0
Complexity80
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