Methyl 4-Morpholinobenzoate - CAS 23676-05-3

Name: Methyl 4-Morpholinobenzoate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB018135
Product Name:	Methyl 4-Morpholinobenzoate
CAS:	23676-05-3
Synonyms:	4-(4-morpholinyl)benzoic acid methyl ester; methyl 4-morpholin-4-ylbenzoate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 4-morpholin-4-ylbenzoate
Description:	Methyl 4-Morpholinobenzoate (CAS# 23676-05-3) is a useful research chemical.
Molecular Weight:	221.25
Molecular Formula:	C12H15NO3
Canonical SMILES:	COC(=O)C1=CC=C(C=C1)N2CCOCC2
InChI:	InChI=1S/C12H15NO3/c1-15-12(14)10-2-4-11(5-3-10)13-6-8-16-9-7-13/h2-5H,6-9H2,1H3
InChI Key:	MMSNLLYQDUZFFR-UHFFFAOYSA-N
Boiling Point:	371.9 °C at 760 mmHg
Density:	1.16 g/cm³
LogP:	1.37480

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Publication Number	Title	Priority Date
US-2019345122-A1	Methods for forming aryl carbon-nitrogen bonds using light and photoreactors useful for conducting such reactions	20180508
US-2020147581-A1	Methods for forming aryl carbon-nitrogen bonds using light and photoreactors useful for conducting such reactions	20180508
CN-112262128-A	Method for forming aryl carbon-nitrogen bond by illumination and photoreactor for carrying out the reaction	20180508
KR-20210013073-A	How to use light to form aryl carbon-nitrogen bonds and photoreactors useful for carrying out these reactions	20180508
US-11104653-B2	Methods for forming aryl carbon-nitrogen bond using light	20180508

Complexity:	230
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.10519334
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	221.10519334
Rotatable Bond Count:	3
Topological Polar Surface Area:	38.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5