3-Amino-4-chlorophenol - CAS 16026-77-0
Catalog: |
BB011616 |
Product Name: |
3-Amino-4-chlorophenol |
CAS: |
16026-77-0 |
Synonyms: |
3-amino-4-chlorophenol |
IUPAC Name: | 3-amino-4-chlorophenol |
Description: | 3-Amino-4-chlorophenol (CAS# 16026-77-0) is a useful research chemical, an inhibitor of Malassezia globosa carbonic anhydrase. |
Molecular Weight: | 143.57 |
Molecular Formula: | C6H6ClNO |
Canonical SMILES: | C1=CC(=C(C=C1O)N)Cl |
InChI: | InChI=1S/C6H6ClNO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H,8H2 |
InChI Key: | FWUALUHYKLDYAN-UHFFFAOYSA-N |
Boiling Point: | 282.8 °C at 760 mmHg |
Melting Point: | 151-154 °C |
Purity: | 95 % |
Density: | 1.406 g/cm3 |
MDL: | MFCD03427127 |
LogP: | 2.20900 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021083167-A1 | Substituted heterocyclic fused cyclic compound, preparation method therefor and pharmaceutical use thereof | 20191030 |
WO-2021053495-A1 | Bifunctional degraders and their methods of use | 20190916 |
WO-2020023911-A2 | Near-infrared nerve-sparing fluorophores | 20180727 |
CA-3069432-A1 | Substituted benzoxazole and benzofuran compounds as pde7 inhibitors | 20170712 |
EP-3652180-A1 | Substituted benzoxazole and benzofuran compounds as pde7 inhibitors | 20170712 |
Complexity: | 99.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.0137915 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.0137915 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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