Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 445211Erstellt: 26. Oktober 2026

9-(2-Hydroxypropyl)adenine, (R)-

Tenofovir Impurity 91 · (R)-9-(2-HydroxypropyL · Tenofovir alafenamide-30 · Tenofovir Impurity 1 CRS · Intermediate of Tenofovir · MJZYTEBKXLVLMY-RXMQYKEDSA-N · Tenofovir Related Compound 11 · (R)-9-(2-Hydroxypropyl)ademine

https://huagongshe.com/de/chemical/445211

Molekülstruktur von 9-(2-Hydroxypropyl)adenine, (R)-

Identifikatoren & physikalische Daten

CAS No.14047-28-0
SummenformelC8H11N5O
Durchschnittliche Molmasse193,21 g/mol
Monoisotopische Masse193,09635997 g/mol
SMILESC[C@@H](O)Cn1cnc2c(N)ncnc21
InChIKeyMJZYTEBKXLVLMY-RXMQYKEDSA-N
PubChem CID445211
EC No.108-862-0
DTXSIDDTXSID20332178

Chemische & physikalische Eigenschaften

XLogP-0,4
Polarare Oberfläche (TPSA)89,9
H-Brücken-Donoren2
H-Brücken-Akzeptoren5
Frei drehbare Bindungen2
Schwere Atome14
Formalladung0
Komplexität202
ArzneimittelPharmaceuticals -> Listed in ZINC15
Schmelzpunkt193 °C
Siedepunkt457.7±55.0 °C(Predicted)
Dichte1.57
LagerbedingungenKeep in dark place,Inert atmosphere,2-8°C
LöslichkeitDMSO (Slightly), Ethanol (Slightly), Methanol (Slightly, Heated)
AggregatzustandSolid
pKa (Säurekonstante)14.42±0.20(Predicted)
FarbeWhite to Off-White
InChIInChI=1/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)/t5-/s3
InChIKeyMJZYTEBKXLVLMY-GQMHJJTINA-N
SMILESN1(C[C@@H](C)O)C=NC2C(=NC=NC1=2)N |&1:2,r|

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)Acute Tox. 4 (100%)
Zollcode2933.99.8290

Anwendungen & Verwendung

Verwenden

(R)-9-[2-(Hydroxypropyl] Adenine (Desphosphoryl Tenofovir) (cas# 14047-28-0) is a useful reagent for preparing the antiviral drug tenofovir.