Home Other Building Blocks 7-Phenylcarbamoylheptanoic acid

7-Phenylcarbamoylheptanoic acid

CAS No.:
149648-52-2
Catalog Number:
AG001LWE
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$305
- +
1g
97%
1 week
United States
$703
- +
Product Description
Catalog Number:
AG001LWE
Chemical Name:
7-Phenylcarbamoylheptanoic acid
CAS Number:
149648-52-2
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
MDL Number:
MFCD07777004
IUPAC Name:
8-anilino-8-oxooctanoic acid
InChI:
InChI=1S/C14H19NO3/c16-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(17)18/h3-5,8-9H,1-2,6-7,10-11H2,(H,15,16)(H,17,18)
InChI Key:
PAXDAFSGJPGLGR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)CCCCCCC(=O)O
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Histone deacetylase inhibitors reverse gene silencing in Friedreich's ataxia. Nature chemical biology 20061001
Properties