N1-(4-Bromophenyl)-1,2-benzenediamine - CAS 100953-52-4
Catalog: |
BB000399 |
Product Name: |
N1-(4-Bromophenyl)-1,2-benzenediamine |
CAS: |
100953-52-4 |
Synonyms: |
N2-(4-bromophenyl)benzene-1,2-diamine; 2-N-(4-bromophenyl)benzene-1,2-diamine |
IUPAC Name: | 2-N-(4-bromophenyl)benzene-1,2-diamine |
Description: | N1-(4-Bromophenyl)-1,2-benzenediamine (CAS# 100953-52-4 ) is a useful research chemical. |
Molecular Weight: | 263.13 |
Molecular Formula: | C12H11BrN2 |
Canonical SMILES: | C1=CC=C(C(=C1)N)NC2=CC=C(C=C2)Br |
InChI: | InChI=1S/C12H11BrN2/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h1-8,15H,14H2 |
InChI Key: | LCLAHXCIHJAZIF-UHFFFAOYSA-N |
LogP: | 4.42910 |
Publication Number | Title | Priority Date |
CN-111747933-A | Substituted 1,3, 5-triazine compound, composition and application thereof | 20190329 |
CN-111747937-A | 1,3, 5-triazine compound, composition and application thereof | 20190329 |
WO-2020199996-A1 | Substituted 1,3,5-triazine compound, composition and application thereof | 20190329 |
WO-2020199998-A1 | 1,3,5-triazine compound and composition, and application thereof | 20190329 |
TW-202035377-A | Substituted 1,3,5-triazine compounds, compositions and applications thereof | 20190329 |
Complexity: | 190 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.01056 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.01056 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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