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Home Other Building Blocks (4-Chlorobenzoyl)pyrrolidine

(4-Chlorobenzoyl)pyrrolidine

CAS No.:
19202-05-2
Catalog Number:
AG002FM1
Molecular Formula:
C11H12ClNO
Molecular Weight:
209.6721
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$63
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG002FM1
Chemical Name:
(4-Chlorobenzoyl)pyrrolidine
CAS Number:
19202-05-2
Molecular Formula:
C11H12ClNO
Molecular Weight:
209.6721
MDL Number:
MFCD00587049
IUPAC Name:
(4-chlorophenyl)-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C11H12ClNO/c12-10-5-3-9(4-6-10)11(14)13-7-1-2-8-13/h3-6H,1-2,7-8H2
InChI Key:
DDDOTKBSNHPPNT-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)N1CCCC1
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.673g/mol
Monoisotopic Mass:
209.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties