2-(2-Bromophenoxy)-4-methyl-1-nitrobenzene - CAS 1516187-55-5
Catalog: |
BB061976 |
Product Name: |
2-(2-Bromophenoxy)-4-methyl-1-nitrobenzene |
CAS: |
1516187-55-5 |
Synonyms: |
2-(2-Bromophenoxy)-4-methyl-1-nitrobenzene |
IUPAC Name: | 2-(2-bromophenoxy)-4-methyl-1-nitrobenzene |
Description: | 2-(2-Bromophenoxy)-4-methyl-1-nitrobenzene |
Molecular Weight: | 308.12 |
Molecular Formula: | C13H10BrNO3 |
Canonical SMILES: | CC1=CC(=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2Br |
InChI: | InChI=1S/C13H10BrNO3/c1-9-6-7-11(15(16)17)13(8-9)18-12-5-3-2-4-10(12)14/h2-8H,1H3 |
InChI Key: | BMCBCKMNZVMMQL-UHFFFAOYSA-N |
Complexity: | 295 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 306.98441 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.98441 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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