Home Halogens Dimethyl 2-(5-bromo-2-nitrophenyl)malonate

Dimethyl 2-(5-bromo-2-nitrophenyl)malonate

CAS No.:
1417407-96-5
Catalog Number:
AG00HW7C
Molecular Formula:
C11H10BrNO6
Molecular Weight:
332.1042
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$225
- +
1g
98%
In Stock USA
United States
$563
- +
5g
98%
In Stock USA
United States
$1688
- +
Product Description
Catalog Number:
AG00HW7C
Chemical Name:
Dimethyl 2-(5-bromo-2-nitrophenyl)malonate
CAS Number:
1417407-96-5
Molecular Formula:
C11H10BrNO6
Molecular Weight:
332.1042
MDL Number:
MFCD28359592
IUPAC Name:
dimethyl 2-(5-bromo-2-nitrophenyl)propanedioate
InChI:
InChI=1S/C11H10BrNO6/c1-18-10(14)9(11(15)19-2)7-5-6(12)3-4-8(7)13(16)17/h3-5,9H,1-2H3
InChI Key:
KWBWIWMMGAYKFS-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cc(Br)ccc1[N+](=O)[O-])C(=O)OC
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.969g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.106g/mol
Monoisotopic Mass:
330.969g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties