Home Other Building Blocks 3-(4-Nitrophenyl)pentanedioic acid

3-(4-Nitrophenyl)pentanedioic acid

CAS No.:
92289-14-0
Catalog Number:
AG00699O
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$121
- +
5g
97%
1 week
United States
$289
- +
Product Description
Catalog Number:
AG00699O
Chemical Name:
3-(4-Nitrophenyl)pentanedioic acid
CAS Number:
92289-14-0
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
MDL Number:
MFCD11110458
IUPAC Name:
3-(4-nitrophenyl)pentanedioic acid
InChI:
InChI=1S/C11H11NO6/c13-10(14)5-8(6-11(15)16)7-1-3-9(4-2-7)12(17)18/h1-4,8H,5-6H2,(H,13,14)(H,15,16)
InChI Key:
YNPLFNKGJKRZNX-UHFFFAOYSA-N
SMILES:
OC(=O)CC(c1ccc(cc1)[N+](=O)[O-])CC(=O)O
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.059g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.21g/mol
Monoisotopic Mass:
253.059g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties