Home Halogens N-(4-Sec-butylphenyl)-3-chloropropanamide

N-(4-Sec-butylphenyl)-3-chloropropanamide

CAS No.:
20331-29-7
Catalog Number:
AG0028TK
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG0028TK
Chemical Name:
N-(4-Sec-butylphenyl)-3-chloropropanamide
CAS Number:
20331-29-7
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
MDL Number:
MFCD02973804
IUPAC Name:
N-(4-butan-2-ylphenyl)-3-chloropropanamide
InChI:
InChI=1S/C13H18ClNO/c1-3-10(2)11-4-6-12(7-5-11)15-13(16)8-9-14/h4-7,10H,3,8-9H2,1-2H3,(H,15,16)
InChI Key:
LNERRDGMCUENRC-UHFFFAOYSA-N
SMILES:
ClCCC(=O)Nc1ccc(cc1)C(CC)C
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.108g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.743g/mol
Monoisotopic Mass:
239.108g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties