(R)-(+)-4-Isopropyl-2-oxazolidinone

CAS
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Purity
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CAS
95530-58-8
Size
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Purity
98%
Price
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Availability
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Catalog Number

ACM95530588-1

Product Name

(R)-(+)-4-Isopropyl-2-oxazolidinone

Structure

Structure

CAS

95530-58-8

Category

Heterocyclic Organic Compound

Synonyms

(R)-4-Isopropyloxazolidin-2-One; (4R)-4-(Propan-2-Yl)-1,3-Oxazolidin-2-One

IUPAC Name

(4R)-4-propan-2-yl-1,3-oxazolidin-2-one

Molecular Weight

129.16

Molecular Formula

C6H11NO2

Canonical SMILES

CC(C)C1COC(=O)N1

InChI

YBUPWRYTXGAWJX-YFKPBYRVSA-N

InChI Key

InChI=1S/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8)/t5-/m0/s1

Boiling Point

291.1ºC at 760 mmHg

Melting Point

70-72 °C-lit

Flash Point

129.9ºC

Density

1.038 g/cm³

Appearance

Beige crystalline

EC Number

619-146-7

Exact Mass

129.07900

Hazard Statements

Xi

H-Bond Acceptor

2

H-Bond Donor

1

Isomeric SMILES

CC(C)[C@@H]1COC(=O)N1

Safety Description

S22-S24/25

WGK Germany

3

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the PubChem CID for (R)-(+)-4-Isopropyl-2-oxazolidinone?

The PubChem CID for (R)-(+)-4-Isopropyl-2-oxazolidinone is 641505.

What is the molecular formula of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The molecular formula of (R)-(+)-4-Isopropyl-2-oxazolidinone is C6H11NO2.

What is the molecular weight of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The molecular weight of (R)-(+)-4-Isopropyl-2-oxazolidinone is 129.16 g/mol.

What is the IUPAC name of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The IUPAC name of (R)-(+)-4-Isopropyl-2-oxazolidinone is (4R)-4-propan-2-yl-1,3-oxazolidin-2-one.

What is the InChI of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The InChI of (R)-(+)-4-Isopropyl-2-oxazolidinone is InChI=1S/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8)/t5-/m0/s1.

What is the InChIKey of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The InChIKey of (R)-(+)-4-Isopropyl-2-oxazolidinone is YBUPWRYTXGAWJX-YFKPBYRVSA-N.

What is the canonical SMILES of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The canonical SMILES of (R)-(+)-4-Isopropyl-2-oxazolidinone is CC(C)C1COC(=O)N1.

How many hydrogen bond donor counts does (R)-(+)-4-Isopropyl-2-oxazolidinone have?

(R)-(+)-4-Isopropyl-2-oxazolidinone has 1 hydrogen bond donor count.

What is the XLogP3-AA value of (R)-(+)-4-Isopropyl-2-oxazolidinone?

The XLogP3-AA value of (R)-(+)-4-Isopropyl-2-oxazolidinone is 1.1.

Is (R)-(+)-4-Isopropyl-2-oxazolidinone a canonicalized compound?

Yes, (R)-(+)-4-Isopropyl-2-oxazolidinone is a canonicalized compound according to PubChem.

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