(4R)-4-phenyl-1,3-oxazolidin-2-one

HCID 730425CAS 90319-52-1
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1N[C@H](c2ccccc2)CO1
InChIKey
QDMNNMIOWVJVLY-QMMMGPOBSA-N
Molecular formula
C9H9NO2
Average molar mass
163.17 g/mol
Monoisotopic mass
163.06332853

Names & identifiers

Preferred name
(4R)-4-phenyl-1,3-oxazolidin-2-one
IUPAC
(4R)-4-phenyl-1,3-oxazolidin-2-one
English name
(R)-(-)-4-Phenyl-2-oxazolidinone
Molecular formula
C9H9NO2
Molecular weight
163.17

Names & synonyms

(4R)-4-phenyl-1,3-oxazolidin-2-one(-)-4-Phenyl-2-oxazolidinoneRefChem:403276618-527-590319-52-1(R)-(-)-4-Phenyl-2-oxazolidinone(R)-4-phenyloxazolidin-2-one(R)-4-PHENYL-2-OXAZOLIDINONEMFCD001923932-Oxazolidinone, 4-phenyl-, (4R)-(4R)-4-phenyloxazolidin-2-oneDTXSID50352627
Show more names
(R)-(+)-4-PHENYL-2-OXAZOLIDINONEEzetimibe Impurity 63(R)-PH-OXAZOLIDINONE(R)-(-)-4-Phenyl-2-oElagolix Impurity 22Ezetimibe Impuriry 63-4-PHENYL-2-OXAZOLIDINONE(4R)-PHENYL-2-OXAZOLIDINONE
4-Phenyl-2-oxazolidinone, (4R)-(4R)-(-)-4-phenyl-2-oxazolidinone(4R)-4-phenyl-1,3-oxazolan-2-oneA1IGLP1307(4r)-4-phenyl-2-oxazolidinone(R)-(-)-4-phenyloxazolidin-2-oneD5L96WN6JQ

Database identifiers

CAS
90319-52-1
PubChem CID
730425
DTXSID
DTXSID50352627
UNII
D5L96WN6JQ
EC Number
618-527-5
Nikkaji
J462.968J

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12

Physicochemical properties

Melting point
131 · 131-133 °C(lit.)
alpha
-49.5 · -49.5 º (c=2, CHCl3)
Boiling point
290.25 °C · 290.25°C (rough estimate)
Density
1.2021 · 1.2021 (rough estimate)
refractive index
-72 ° · -72 ° (C=1, AcOEt)
storage temp.
Inert atmosphere,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Acute Tox. 4 (100%)

Safety data

F
3-10
PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
hs_code
29349990
risk_code
12-36
Signal word
Warning

Chemistry & industry

Applications · 3 items

Usessynthon for a-amino acids and b-lactam antibiotics

Uses(R)-(-)-4-Phenyl-2-oxazolidinone (cas# 90319-52-1) is a compound useful in organic synthesis.

UsesUsed for α-amino acid synthesis and the preparation of β-lactam antibiotics.

Upstream & downstream products

Suppliers50 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]

Related reactions

33 records
New reaction record

Linked notes

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