(R)-4-Isopropyl-2-oxazolidinone - CAS 95530-58-8

Catalog:	BB041748
Product Name:	(R)-4-Isopropyl-2-oxazolidinone
CAS:	95530-58-8
Synonyms:	(4R)-4-propan-2-yl-2-oxazolidinone; (4R)-4-propan-2-yl-1,3-oxazolidin-2-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4R)-4-propan-2-yl-1,3-oxazolidin-2-one
Description:	(R)-4-Isopropyl-2-oxazolidinone (CAS# 95530-58-8) is a useful research chemical.
Molecular Weight:	129.16
Molecular Formula:	C6H11NO2
Canonical SMILES:	CC(C)C1COC(=O)N1
InChI:	InChI=1S/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8)/t5-/m0/s1
InChI Key:	YBUPWRYTXGAWJX-YFKPBYRVSA-N
Boiling Point:	291.1 °C / 760 mmHg
Melting Point:	72 °C
Purity:	99 %
Density:	1.038 g/cm³
Appearance:	Powder
Storage:	Room temperature.
MDL:	MFCD00075172
LogP:	1.07960

Publication Number	Title	Priority Date
CN-112264101-A	Preparation method and application of metal organic framework catalyst with torsion structure	20201023
CA-3108168-A1	Conjugates of cell-binding molecules with cytotoxic agents	20200205
EP-3862023-A1	Conjugates of cell-binding molecules with cytotoxic agents	20200205
US-2021094918-A1	Process for the preparation of (s)-netarsudil,its salts and polymorphs	20190629
WO-2021001713-A1	Process for the preparation of (s)-netarsudil, its salts & polymorphs	20190629

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Related Functional Groups

Oxazole/Thiazole

[120740-06-9]
[(2-chloro-1,3-thiazol-5-yl)methyl](methyl)amine
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[13610-81-6]
(2-Oxo-1,3-benzoxazol-3(2H)-yl)acetaldehyde
[262857-90-9]
(R)-4-(4-Aminobenzyl)-2-oxazolidinone
[117043-86-4]
4-(Aminomethyl)thiazole Hydrochloride
[24043-97-8]
Ethyl 2-(2-thienyl)thiazole-4-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	129.078978594
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	129.078978594
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1