Home Carbonyls (4-Bromo-3-methylphenylcarbonyl)pyrrolidine

(4-Bromo-3-methylphenylcarbonyl)pyrrolidine

CAS No.:
149105-15-7
Catalog Number:
AG001LDU
Molecular Formula:
C12H14BrNO
Molecular Weight:
268.1497
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG001LDU
Chemical Name:
(4-Bromo-3-methylphenylcarbonyl)pyrrolidine
CAS Number:
149105-15-7
Molecular Formula:
C12H14BrNO
Molecular Weight:
268.1497
MDL Number:
MFCD09972125
IUPAC Name:
(4-bromo-3-methylphenyl)-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C12H14BrNO/c1-9-8-10(4-5-11(9)13)12(15)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3
InChI Key:
RCAQDBSEMTZVRD-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)C)Br)N1CCCC1
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.026g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.154g/mol
Monoisotopic Mass:
267.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties