sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Parcetasal

Parcetasal

CAS No.:
87549-36-8
Catalog Number:
AG01E5MA
Molecular Formula:
C17H15NO5
Molecular Weight:
313.3047
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$223
- +
5mg
99%
1 week
United States
$390
- +
10mg
99%
1 week
United States
$623
- +
20mg
99%
1 week
United States
$1057
- +
Product Description
Catalog Number:
AG01E5MA
Chemical Name:
Parcetasal
CAS Number:
87549-36-8
Molecular Formula:
C17H15NO5
Molecular Weight:
313.3047
MDL Number:
MFCD00866092
IUPAC Name:
N-[4-[(2-methyl-4-oxo-1,3-benzodioxin-2-yl)oxy]phenyl]acetamide
InChI:
InChI=1S/C17H15NO5/c1-11(19)18-12-7-9-13(10-8-12)21-17(2)22-15-6-4-3-5-14(15)16(20)23-17/h3-10H,1-2H3,(H,18,19)
InChI Key:
ZAPRLADYRFPQSH-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)OC1(C)OC(=O)c2c(O1)cccc2
Properties
Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.095g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
313.309g/mol
Monoisotopic Mass:
313.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties