2-(4-Morpholinylcarbonyl)aniline - CAS 39630-24-5
Catalog: |
BB024062 |
Product Name: |
2-(4-Morpholinylcarbonyl)aniline |
CAS: |
39630-24-5 |
Synonyms: |
(2-aminophenyl)-morpholin-4-ylmethanone |
IUPAC Name: | (2-aminophenyl)-morpholin-4-ylmethanone |
Description: | 2-(4-Morpholinylcarbonyl)aniline (CAS# 39630-24-5) is a useful research chemical. |
Molecular Weight: | 206.24 |
Molecular Formula: | C11H14N2O2 |
Canonical SMILES: | C1COCCN1C(=O)C2=CC=CC=C2N |
InChI: | InChI=1S/C11H14N2O2/c12-10-4-2-1-3-9(10)11(14)13-5-7-15-8-6-13/h1-4H,5-8,12H2 |
InChI Key: | LFLIOZKEABTZIF-UHFFFAOYSA-N |
Boiling Point: | 411.6 °C at 760 mmHg |
Density: | 1.228 g/cm3 |
MDL: | MFCD00034763 |
LogP: | 1.26030 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3331865-A1 | Synthesis of benzodiazepine derivatives | 20150807 |
JP-2018523660-A | Synthesis of benzodiazepine derivatives | 20150807 |
US-10570102-B2 | Synthesis of benzodiazepine derivatives | 20150807 |
US-2018237400-A1 | Synthesis Of Benzodiazepine Derivatives | 20150807 |
WO-2017025727-A1 | Synthesis of benzodiazepine derivatives | 20150807 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.105527694 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.105527694 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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