Home Nitros Methyl 4-(3-nitrophenyl)benzoate

Methyl 4-(3-nitrophenyl)benzoate

CAS No.:
89900-93-6
Catalog Number:
AG00GTFO
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00GTFO
Chemical Name:
Methyl 4-(3-nitrophenyl)benzoate
CAS Number:
89900-93-6
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
MDL Number:
MFCD01846431
IUPAC Name:
methyl 4-(3-nitrophenyl)benzoate
InChI:
InChI=1S/C14H11NO4/c1-19-14(16)11-7-5-10(6-8-11)12-3-2-4-13(9-12)15(17)18/h2-9H,1H3
InChI Key:
PMHCOLXQSXMKJJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.069g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.245g/mol
Monoisotopic Mass:
257.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties