Home Carbonyls 5-Bromo-2-(pyrrolidinocarbonyl)anisole

5-Bromo-2-(pyrrolidinocarbonyl)anisole

CAS No.:
1257664-97-3
Catalog Number:
AG000OOD
Molecular Formula:
C12H14BrNO2
Molecular Weight:
284.1491
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
10g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG000OOD
Chemical Name:
5-Bromo-2-(pyrrolidinocarbonyl)anisole
CAS Number:
1257664-97-3
Molecular Formula:
C12H14BrNO2
Molecular Weight:
284.1491
MDL Number:
MFCD18087702
IUPAC Name:
(4-bromo-2-methoxyphenyl)-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C12H14BrNO2/c1-16-11-8-9(13)4-5-10(11)12(15)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3
InChI Key:
VBRHKYBMZIGYMK-UHFFFAOYSA-N
SMILES:
COc1cc(Br)ccc1C(=O)N1CCCC1
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.021g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.153g/mol
Monoisotopic Mass:
283.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties