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3-Bromo-4-hydrazinylpyridine

CAT: 0127-OR510023Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR510023Size:250 mg
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CAS Number
1202941-04-5
MDL Number
MFCD00234090
Purity
>97%
Smiles
NNc1ccncc1Br
Storage Conditions
Store at -20°C

Chemical Information

3-Bromo-4-hydrazinylpyridine
CAS Number1202941-04-5
PubChem CID817130
IUPAC Name(3-bromo-4-pyridinyl)hydrazine
Molecular FormulaC5H6BrN3
Molecular Weight188.03
XLogP0.8
Topological Polar Surface Area50.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity88
SMILES
C1=CN=CC(=C1NN)Br
InChI
InChI=1S/C5H6BrN3/c6-4-3-8-2-1-5(4)9-7/h1-3H,7H2,(H,8,9)
InChIKey
YQFOKCAJSZDRHX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Bromo-4-hydrazinylpyridine
CAS: 1202941-04-5
CID: 817130
Formula: C5H6BrN3
MW: 188.03
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.03
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass186.97451
Monoisotopic Mass186.97451
Topological Polar Surface Area50.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity88.3
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