Home Halogens methyl 2-(3-bromo-2-nitrophenyl)acetate

methyl 2-(3-bromo-2-nitrophenyl)acetate

CAS No.:
1261653-58-0
Catalog Number:
AG01B7M1
Molecular Formula:
C9H8BrNO4
Molecular Weight:
274.0681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B7M1
Chemical Name:
methyl 2-(3-bromo-2-nitrophenyl)acetate
CAS Number:
1261653-58-0
Molecular Formula:
C9H8BrNO4
Molecular Weight:
274.0681
MDL Number:
MFCD18398873
IUPAC Name:
methyl 2-(3-bromo-2-nitrophenyl)acetate
InChI:
InChI=1S/C9H8BrNO4/c1-15-8(12)5-6-3-2-4-7(10)9(6)11(13)14/h2-4H,5H2,1H3
InChI Key:
PBKQXTVZNYOCFB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(CC(=O)OC)cccc1Br
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.964g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.07g/mol
Monoisotopic Mass:
272.964g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties