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Home Other Building Blocks 1-Phenacylpyridinium bromide

1-Phenacylpyridinium bromide

CAS No.:
16883-69-5
Catalog Number:
AG003ELG
Molecular Formula:
C13H12BrNO
Molecular Weight:
278.1445
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$113
- +
100g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG003ELG
Chemical Name:
1-Phenacylpyridinium bromide
CAS Number:
16883-69-5
Molecular Formula:
C13H12BrNO
Molecular Weight:
278.1445
MDL Number:
MFCD00031995
IUPAC Name:
1-phenyl-2-pyridin-1-ium-1-ylethanone;bromide
InChI:
InChI=1S/C13H12NO.BrH/c15-13(12-7-3-1-4-8-12)11-14-9-5-2-6-10-14;/h1-10H,11H2;1H/q+1;/p-1
InChI Key:
PXSUMUYPXZEXDT-UHFFFAOYSA-M
SMILES:
O=C(c1ccccc1)C[n+]1ccccc1.[Br-]
EC Number:
240-919-6
NSC Number:
2535
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.01g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.149g/mol
Monoisotopic Mass:
277.01g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Direct ortho-arylation of N-phenacylpyridinium bromide by palladium-catalyzed C-H-bond activation. Chemistry (Weinheim an der Bergstrasse, Germany) 20091207
Properties