N-Boc-3-(hydroxymethyl)morpholine - CAS 473923-56-7

Catalog:	BB026272
Product Name:	N-Boc-3-(hydroxymethyl)morpholine
CAS:	473923-56-7
Synonyms:	3-(hydroxymethyl)-4-morpholinecarboxylic acid tert-butyl ester; tert-butyl 3-(hydroxymethyl)morpholine-4-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl 3-(hydroxymethyl)morpholine-4-carboxylate
Description:	N-Boc-3-(hydroxymethyl)morpholine (CAS# 473923-56-7) is a useful research chemical.
Molecular Weight:	217.26
Molecular Formula:	C10H19NO4
Canonical SMILES:	CC(C)(C)OC(=O)N1CCOCC1CO
InChI:	InChI=1S/C10H19NO4/c1-10(2,3)15-9(13)11-4-5-14-7-8(11)6-12/h8,12H,4-7H2,1-3H3
InChI Key:	AIQSXVGBMCJQAG-UHFFFAOYSA-N
Boiling Point:	320.7 °C at 760 mmHg
Density:	1.118 g/cm³
Appearance:	White powder
MDL:	MFCD04038649
LogP:	1.90190

Publication Number	Title	Priority Date
WO-2021190727-A1	Compounds and their use in the treatment of bacterial infection	20200324
WO-2020068867-A1	Quinazoline derivatives as tyrosine kinase inhibitor, compositions, methods of making them and their use	20180925
CN-113382986-A	Tyrosine kinase inhibitor compositions, methods of making and methods of using the same	20180925
EP-3856726-A1	Quinazoline derivatives as tyrosine kinase inhibitor, compositions, methods of making them and their use	20180925
US-11034672-B1	Tyrosine kinase inhibitor compositions, methods of making and methods of use	20180925

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GHS Hazard Statement:	H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P310, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	224
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	217.13140809
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	217.13140809
Rotatable Bond Count:	3
Topological Polar Surface Area:	59 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1