3-Bromo-2-chloroaniline - CAS 56131-46-5
Catalog: |
BB029267 |
Product Name: |
3-Bromo-2-chloroaniline |
CAS: |
56131-46-5 |
Synonyms: |
3-bromo-2-chloroaniline; 3-bromo-2-chloroaniline |
IUPAC Name: | 3-bromo-2-chloroaniline |
Description: | 3-Bromo-2-chloroaniline (CAS# 56131-46-5) is a useful research chemical. |
Molecular Weight: | 206.47 |
Molecular Formula: | C6H5BrClN |
Canonical SMILES: | C1=CC(=C(C(=C1)Br)Cl)N |
InChI: | InChI=1S/C6H5BrClN/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H2 |
InChI Key: | HKNLHCGTRMCOLV-UHFFFAOYSA-N |
LogP: | 3.26590 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P337+P313, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113461538-A | Preparation method of 2-chloro-3-bromoaniline | 20210712 |
CN-112979532-A | Phthalimide compound, preparation method and application | 20210520 |
CN-112979532-B | Phthalimide compound, preparation method and application | 20210520 |
CN-113493469-A | Compound capable of being used as immunomodulator, preparation method and application thereof | 20200318 |
WO-2021158481-A1 | Substituted 1,1'-biphenyl compounds and methods using same | 20200203 |
Complexity: | 99.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.92939 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.92939 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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