3-Chloro-4-morpholinoaniline - CAS 55048-24-3
Catalog: |
BB028900 |
Product Name: |
3-Chloro-4-morpholinoaniline |
CAS: |
55048-24-3 |
Synonyms: |
3-chloro-4-(4-morpholinyl)aniline; 3-chloro-4-morpholin-4-ylaniline |
IUPAC Name: | 3-chloro-4-morpholin-4-ylaniline |
Description: | 3-Chloro-4-morpholinoaniline (CAS# 55048-24-3) is a useful research chemical compound. |
Molecular Weight: | 212.68 |
Molecular Formula: | C10H13ClN2O |
Canonical SMILES: | C1COCCN1C2=C(C=C(C=C2)N)Cl |
InChI: | InChI=1S/C10H13ClN2O/c11-9-7-8(12)1-2-10(9)13-3-5-14-6-4-13/h1-2,7H,3-6,12H2 |
InChI Key: | BBUAXVLPFRRBQR-UHFFFAOYSA-N |
Boiling Point: | 399.1 ℃ at 760 mmHg |
Density: | 1.273 g/cm3 |
LogP: | 2.40500 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020183011-A1 | Htr1d inhibitors and uses thereof in the treatment of cancer | 20190314 |
WO-2020120141-A1 | Functionalised amine derivatives as il-17 modulators | 20181211 |
CN-113260418-A | Functionalized amine derivatives as IL-17 modulators | 20181211 |
EP-3894003-A1 | Functionalised amine derivatives as il-17 modulators | 20181211 |
WO-2020069418-A1 | Small molecule inhibitors of dyrk1/clk and uses thereof | 20180928 |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.0716407 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.0716407 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Amines and Anilines
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