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4-Bromopyridine-2-carboxaldehyde

CAT: 0572-TRC-B686135-10GSize: 10 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B686135-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
131747-63-2
Synonyms
4-Bromo-2-formylpyridine; 4-Bromopicolinaldehyde
Hazard Statement
Harmful if swallowed
Smiles
Brc1ccnc(C=O)c1
Molecular Formula
C6 H4 Br N O
Molecular Weight
186.01
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

4-Bromopyridine-2-carbaldehyde
CAS Number131747-63-2
PubChem CID14761472
IUPAC Name4-bromopyridine-2-carbaldehyde
Molecular FormulaC6H4BrNO
Molecular Weight186.01
XLogP1.3
Topological Polar Surface Area30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity107
SMILES
C1=CN=C(C=C1Br)C=O
InChI
InChI=1S/C6H4BrNO/c7-5-1-2-8-6(3-5)4-9/h1-4H
InChIKey
CKVQWOKUEZYWRQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Bromopyridine-2-carbaldehyde
CAS: 131747-63-2
CID: 14761472
Formula: C6H4BrNO
MW: 186.01
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight186.01
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass184.94763
Monoisotopic Mass184.94763
Topological Polar Surface Area30 Ų
Heavy Atom Count9
Formal Charge0
Complexity107
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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Alternative Products

CatalogName
431308-014-Bromopyridine-2-carboxaldehyde
261775-012-Bromopyridine-4-carboxaldehyde
abx185771-013-Bromopyridine-4-carboxaldehyde
MBS6118851-016-Bromopyridine-2-carboxaldehyde
424708-013-Bromopyridine-2-carboxaldehyde
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