Methyl 2-Amino-5-fluoro-4-morpholinobenzoate - CAS 864292-15-9
Catalog: |
BB037926 |
Product Name: |
Methyl 2-Amino-5-fluoro-4-morpholinobenzoate |
CAS: |
864292-15-9 |
Synonyms: |
2-amino-5-fluoro-4-(4-morpholinyl)benzoic acid methyl ester; methyl 2-amino-5-fluoro-4-morpholin-4-ylbenzoate |
IUPAC Name: | methyl 2-amino-5-fluoro-4-morpholin-4-ylbenzoate |
Description: | Methyl 2-Amino-5-fluoro-4-morpholinobenzoate (CAS# 864292-15-9 ) is a useful research chemical. |
Molecular Weight: | 254.26 |
Molecular Formula: | C12H15FN2O3 |
Canonical SMILES: | COC(=O)C1=CC(=C(C=C1N)N2CCOCC2)F |
InChI: | InChI=1S/C12H15FN2O3/c1-17-12(16)8-6-9(13)11(7-10(8)14)15-2-4-18-5-3-15/h6-7H,2-5,14H2,1H3 |
InChI Key: | UJNUQTLHSPITTG-UHFFFAOYSA-N |
LogP: | 1.67730 |
Complexity: | 297 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.10667051 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.10667051 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 64.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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