Home Halogens Phenol, 2,6-dibromo-3-methyl-4-nitro-

Phenol, 2,6-dibromo-3-methyl-4-nitro-

CAS No.:
14401-03-7
Catalog Number:
AG001IRV
Molecular Formula:
C7H5Br2NO3
Molecular Weight:
310.9275
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Product Description
Catalog Number:
AG001IRV
Chemical Name:
Phenol, 2,6-dibromo-3-methyl-4-nitro-
CAS Number:
14401-03-7
Molecular Formula:
C7H5Br2NO3
Molecular Weight:
310.9275
MDL Number:
MFCD04038152
IUPAC Name:
2,6-dibromo-3-methyl-4-nitrophenol
InChI:
InChI=1S/C7H5Br2NO3/c1-3-5(10(12)13)2-4(8)7(11)6(3)9/h2,11H,1H3
InChI Key:
IPHPHFJJKHXWHH-UHFFFAOYSA-N
SMILES:
Brc1cc([N+](=O)[O-])c(c(c1O)Br)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.862g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
310.929g/mol
Monoisotopic Mass:
308.864g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties