Methyl 2-Amino-4-morpholinobenzoate - CAS 404010-84-0
Catalog: |
BB024488 |
Product Name: |
Methyl 2-Amino-4-morpholinobenzoate |
CAS: |
404010-84-0 |
Synonyms: |
2-amino-4-(4-morpholinyl)benzoic acid methyl ester; methyl 2-amino-4-morpholin-4-ylbenzoate |
IUPAC Name: | methyl 2-amino-4-morpholin-4-ylbenzoate |
Description: | Methyl 2-Amino-4-morpholinobenzoate (CAS# 404010-84-0) is a useful research chemical. |
Molecular Weight: | 236.27 |
Molecular Formula: | C12H16N2O3 |
Canonical SMILES: | COC(=O)C1=C(C=C(C=C1)N2CCOCC2)N |
InChI: | InChI=1S/C12H16N2O3/c1-16-12(15)10-3-2-9(8-11(10)13)14-4-6-17-7-5-14/h2-3,8H,4-7,13H2,1H3 |
InChI Key: | XQTXHIWXBHFMRZ-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 1.53820 |
Publication Number | Title | Priority Date |
EP-1351946-A2 | Materials and methods to potentiate cancer treatment | 20000901 |
US-2002165218-A1 | Materials and methods to potentiate cancer treatment | 20000901 |
US-2008090782-A1 | Materials and methods to potentiate cancer treatment | 20000901 |
US-7179912-B2 | Materials and methods to potentiate cancer treatment | 20000901 |
US-8242115-B2 | Materials and methods to potentiate cancer treatment | 20000901 |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.11609238 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.11609238 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 64.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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