2- (Bromomethyl) -4-nitropyridine

CAT: 0127-OR1040162-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1040162-01Size:250 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

442910-43-2

MDL Number

MFCD07368192

Purity

98%

Smiles

O=[N+](C1=CC(CBr)=NC=C1)[O-]

Chemical Information

2-(Bromomethyl)-4-nitropyridine

CAS Number	442910-43-2
PubChem CID	21874575
IUPAC Name	2-(bromomethyl)-4-nitropyridine
Molecular Formula	C6H5BrN2O2
Molecular Weight	217.02
XLogP	1.3
Topological Polar Surface Area	58.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	148

SMILES

C1=CN=C(C=C1[N+](=O)[O-])CBr

InChI

InChI=1S/C6H5BrN2O2/c7-4-5-3-6(9(10)11)1-2-8-5/h1-3H,4H2

InChIKey

OUGUTAUSQAZEJH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 442910-43-2

CID: 21874575

Formula: C6H5BrN2O2

MW: 217.02

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	217.02
XLogP3	1.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	215.95344
Monoisotopic Mass	215.95344
Topological Polar Surface Area	58.7 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	148
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR200119-01	3- (Bromomethyl) -2-nitropyridine
OR1072576-01	5- (Bromomethyl) -2-nitropyridine
OR510067	2- (Bromomethyl) -5-nitropyridine
OR81830-01	2-Ethynyl-4-nitropyridine
PC99879-01	4-Fluoro-2-nitropyridine
OR77223-01	4-Bromo-2-nitropyridine
OR1045007-01	2- (Chloromethyl) -4-nitropyridine
OR315152-01	2-Hydroxy-4-nitropyridine
OR9449-01	2-Methyl-4-nitropyridine
PC2992-01	2-Fluoro-4-nitropyridine

Catalog	Name
JH916574	2- (bromomethyl) -6-nitroPyridine
TRC-B993650-500MG	5-(Bromomethyl)-2-nitropyridine
QZB95188-01	4- (Bromomethyl) -4-fluorooxane
LEA51148-01	4- (Bromomethyl) -4-ethoxyoxane
BEA65429-01	4- (Bromomethyl) heptane
DGA99399-01	4- (Bromomethyl) picolinonitrile
266936-01	4- (Bromomethyl) tetrahydropyran
264513-01	4- (Bromomethyl) phenol
abx185199-01	4-Bromomethyl-Benzenesulfonamide
sc-261383	4- (Bromomethyl) benzaldehyde