(R)-4-Boc-morpholine-3-carboxylic acid - CAS 869681-70-9

Catalog:	BB038145
Product Name:	(R)-4-Boc-morpholine-3-carboxylic acid
CAS:	869681-70-9
Synonyms:	(3R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	(3R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid
Description:	(R)-4-Boc-morpholine-3-carboxylic acid (CAS# 869681-70-9) is a useful research chemical.
Molecular Weight:	231.25
Molecular Formula:	C10H17NO5
Canonical SMILES:	CC(C)(C)OC(=O)N1CCOCC1C(=O)O
InChI:	InChI=1S/C10H17NO5/c1-10(2,3)16-9(14)11-4-5-15-6-7(11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)/t7-/m1/s1
InChI Key:	KVXXEKIGMOEPSA-SSDOTTSWSA-N
Boiling Point:	369.5 °C at 760 mmHg
Purity:	95 %
Density:	1.23 g/cm³
MDL:	MFCD04114909
LogP:	0.64480

Publication Number	Title	Priority Date
CN-111533708-A	Preparation method of chiral N-tert-butoxycarbonylmorpholine-3-carboxylic acid	20200612
CN-111533708-B	Preparation method of chiral N-tert-butoxycarbonylmorpholine-3-carboxylic acid	20200612
WO-2021212039-A1	Inhibitors of cysteine proteases and methods of use thereof	20200417
WO-2021102410-A1	Naphtho[2,1 -d]thiazole derivatives, compositions thereof and methods of treating disorders	20191122
WO-2020025517-A1	Tlr7/8 antagonists and uses thereof	20180731

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GHS Hazard Statement:	H302 (33.33%): 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

Complexity:	283
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	231.11067264
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	231.11067264
Rotatable Bond Count:	3
Topological Polar Surface Area:	76.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4