(R)-(-)-Glycidyl-4-nitrobenzenesulfonate

HCID 14292098

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Grundinformationen

CAS: 123750-60-7
Standard-SMILES: O=[N+]([O-])c1ccc(S(=O)(=O)OC[C@H]2CO2)cc1
InChIKey: CXYDYDCHYJXOEY-MRVPVSSYSA-N
Summenformel: C9H9NO6S
Durchschnittliche Molmasse: 259,24 g/mol
Monoisotopische Masse: 259,01505818

Namen und Bezeichner

Bevorzugter Name: (R)-(-)-Glycidyl-4-nitrobenzenesulfonate
IUPAC: [(2R)-oxiran-2-yl]methyl 4-nitrobenzenesulfonate
Englischer Name: (R)-(-)-Glycidyl-4-nitrobenzenesulfonate
Summenformel: C9H9NO6S
Molmasse: 259.24

Namen und Synonyme

123750-60-7(R)-(-)-Glycidyl-4-nitrobenzenesulfonate(R)-Oxiran-2-ylmethyl 4-nitrobenzenesulfonateBenzenesulfonic acid, 4-nitro-, (2R)-2-oxiranylmethyl esterGlycidyl (R)-(-)-4-nitrobenzenesulfonateMFCD08460169[(2R)-oxiran-2-yl]methyl 4-nitrobenzenesulfonate[(2R)-oxiran-2-yl]methyl 4-nitrobenzene-1-sulfonate118629-64-4(R)-Glycidyl 4-nitrobenzene sulfonate(r)-glycidylnosylateSCHEMBL9645456

Weitere Namen anzeigen

(R)-(-)-Glycidyl-4-nitrobenzenesulfonate 97%Glycidyl (R)-(-)-4-nitrobenzenesulfonate, 97+%

(R)-(-)-GLYCIDYL-4-NITROBENZENESULFONATE 99+%Benzenesulfonic acid, 4-nitro-, (2R)-oxiranylmethyl esterBenzenesulfonic acid,4-nitro-,(2R)-2-oxiranylmethyl esterCXYDYDCHYJXOEY-MRVPVSSYSA-NAKOS025401460AC-18294AS-70773(R)-Oxiran-2-ylmethyl4-nitrobenzenesulfonate

Datenbank-Bezeichner

CAS: 123750-60-7
PubChem CID: 14292098
EC Number: 681-216-8
Nikkaji: J1.559.656B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,7
Polarare Oberfläche (TPSA): 110 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 6
Frei drehbare Bindungen: 4
Schwere Atome: 17
Formalladung: 0
Komplexität: 375

Physikochemische Eigenschaften

InChI: InChI=1S/C9H9NO6S/c11-10(12)7-1-3-9(4-2-7)17(13,14)16-6-8-5-15-8/h1-4,8H,5-6H2/t8-/m1/s1
InChIKey: CXYDYDCHYJXOEY-MRVPVSSYSA-N
SMILES: C1(S(OC[C@H]2CO2)(=O)=O)=CC=C([N+]([O-])=O)C=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 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.