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Home Nitros 4-(Bromomethyl)-3-nitrobenzoic acid

4-(Bromomethyl)-3-nitrobenzoic acid

CAS No.:
55715-03-2
Catalog Number:
AG003L07
Molecular Formula:
C8H6BrNO4
Molecular Weight:
260.0415
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$47
- +
5g
95%
In Stock USA
United States
$130
- +
25g
95%
In Stock USA
United States
$478
- +
Product Description
Catalog Number:
AG003L07
Chemical Name:
4-(Bromomethyl)-3-nitrobenzoic acid
CAS Number:
55715-03-2
Molecular Formula:
C8H6BrNO4
Molecular Weight:
260.0415
MDL Number:
MFCD00216575
IUPAC Name:
4-(bromomethyl)-3-nitrobenzoic acid
InChI:
InChI=1S/C8H6BrNO4/c9-4-6-2-1-5(8(11)12)3-7(6)10(13)14/h1-3H,4H2,(H,11,12)
InChI Key:
QMAHVAFURJBOFV-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1[N+](=O)[O-])C(=O)O
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.948g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.043g/mol
Monoisotopic Mass:
258.948g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Ionic liquid-supported synthesis of dihydroquinazolines and tetrahydroquinazolines under microwave irradiation. Molecular diversity 20120501
Holographically defined nanoparticle placement in 3D colloidal crystals. Journal of the American Chemical Society 20100728
Synthesis of a library of 2-alkyl-3-alkyloxy-2H-indazole-6-carboxamides. Journal of combinatorial chemistry 20070101
Application of polymer-bound 4-(bromomethyl)-3-nitrobenzoic acid for synthesis of trisubstituted 1,4-benzodiazepine-2,3-diones. Molecular diversity 20030101
Properties