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Home> Encyclopedia > Hot Product Listed 2   > 2-Oxazolidinone,4-(1-methylethyl)-3-(1-oxopropyl)-, (4S)-
956755-29-6 structure

2-Oxazolidinone,4-(1-methylethyl)-3-(1-oxopropyl)-, (4S)-

Iupac Name:6-(3,5-dimethylpyrazol-1-yl)-3-(4-methoxyphenyl)-7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine
CAS No.:956755-29-6
Molecular Weight:440.463
Molecular Formula:C13H15NO5S (isomer)
Names and Identifiers
Synonyms

(4s)-(1-methylethyl)-3-(1-oxopropyl)-2-oxazolidinone (4s)-3-(1-oxopropyl)-4-(1-methylethyl)-2-oxazolidinone (4s)-3-propanoyl-4-propan-2-yl-1,3-oxazolidin-2-one (4S)-4-Isopropyl-3-propionyloxazolidin-2-one (s)-(+)-4-isopropyl-3-propionyl (s)-(+)-4-isopropyl-3-propionyl-2-oxazolidinone (s)-(+)-4-isopropyl-3-propionyl-2-oxazolidinone, 98% (S)-4-Isopropyl-3-propanoyl-2-oxazolidinone (S)-4-Isopropyl-3-propionyl-2-oxazolidinone (s)-4-isopropyl-3-propionyloxazolidin-2-one 2-oxazolidinone, 4-(1-methylethyl)-3-(1-oxopropyl)-, (4s)- 2-Oxazolidinone,4-(1-methylethyl)-3-(1-oxopropyl)-, (S)- 3-propanoyl-4beta-isopropyloxazolidine-2-one AC1LGWTR AJ-20840 ak-86880 AX8011405 c-07368 cc-01432 DTXSID20357402 fch3490567 HOWPHXVPNNPSAZ-SSDOTTSWSA-N I0573 mfcd00043401 MOLPORT-003-930-353 RTR-037811 SC-06769 SCHEMBL3627925 ST2402833 TD8073 TL8005337 ZB011764 ZINC389575 zx-at014330

Inchi
InChI=1S/C24H20N6O3/c1-15-11-16(2)28(27-15)22-14-25-24-21(17-7-9-20(33-3)10-8-17)13-26-29(24)23(22)18-5-4-6-19(12-18)30(31)32/h4-14H,1-3H3
InChkey
GJRGOTLCECFAPJ-UHFFFAOYSA-N
Canonical Smiles
CC1=CC(=NN1C2=C(N3C(=C(C=N3)C4=CC=C(C=C4)OC)N=C2)C5=CC(=CC=C5)[N+](=O)[O-])C
Properties
Density
1.34
Boiling Point
353.3°C at 760 mmHg
Flash Point
252.242 °C at 760 mmHg
Storage temp
2-8°C
Safety and Handling
Safety

Safety Information of (S)-(+)-4-Isopropyl-3-propionyl-2-oxazolidinone (CAS NO.77877-19-1):
Hazard Codes: Xi
Risk Statements: 36/37/38 
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin 
Safety Statements: 23-24/25-36-26
23:  Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) 
24:  Avoid contact with skin 
25:  Avoid contact with eyes 
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing

Specification

 (S)-(+)-4-Isopropyl-3-propionyl-2-oxazolidinone ,its CAS NO. is 77877-19-1,the synonyms is (s)-4-Isopropyl-3-propionyl-2-oxazolidinone ; (s)-3-Propionyl-4-isopropyl-2-oxazolidinone ; n-Propionyl-(4s)-isopropyl- 2-oxazolidinone ; (s)-(+)-4-Isopropyl-3-propimyl-2-oxazolidimone ; (s)-(+)-4-Isoprpyl-3-propionyl-2-oxazolidinone .

Computational chemical data
  • Molecular Weight:440.463g/mol
  • Molecular Formula:C13H15NO5S
  • Compound Is Canonicalized:True
  • Exact Mass:440.16
  • Monoisotopic Mass:440.16
  • Complexity:684
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:6
  • Heavy Atom Count:33
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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