(S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanol
Grundinformationen
- CAS
127986-84-9- Standard-SMILES
OC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)[C@@H]1CCCN1- InChIKey
LNUDNNFEXRHHGY-DEOSSOPVSA-N- Summenformel
- C25H23NO
- Durchschnittliche Molmasse
- 353,5 g/mol
- Monoisotopische Masse
- 353,17796436
Namen und Bezeichner
- Bevorzugter Name
- (S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanol
- IUPAC
- dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
- Englischer Name
- (S)-(-)-alpha,alpha-Di(2-naphthyl)-2-pyrrolidinemethanol
- Summenformel
- C25H23NO
- Molmasse
- 353.46
Namen und Synonyme
127986-84-9(S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanoldinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol(s)-(-)-alpha,alpha-di(2-naphthyl)-2-pyrrolidinemethanolbis(2-naphthyl)-[(2S)-pyrrolidin-2-yl]methanol2-Pyrrolidinemethanol, alpha,alpha-di-2-naphthalenyl-, (2S)-((2S)pyrrolidin-2-yl)di(2-naphthyl)methan-1-olC25H23NOMFCD00269672(S)-(-)-|A,|A-Di-(2-naphthyl)-2-pyrrolidine methanolDi(naphthalen-2-yl)[(2S)-pyrrolidin-2-yl]methanolSCHEMBL3849511
Weitere Namen anzeigen
(S)-DI-2-NAPHTHYLPROLINOL(S)-DI-2-NAPHTHYLPROLINOL 99%(S)-Di-2-naphthylprolinol,99%S-α,α-Di-(2-naphthyl)-2-pyrrolidine methanol(S)-(-)-DI-(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL(S)-dinaphthalen-2-yl(pyrrolidin-2-yl)methanol(S)-(-)-A,A-DI(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL2-Pyrrolidinemethanol, α,α-di-2-naphthalenyl-, (2S)-
DTXSID90370007LNUDNNFEXRHHGY-DEOSSOPVSA-NSBB027335AKOS017345033AS-85516ST50405797(S)-dinaphthalen-2-ylpyrrolidin-2-ylmethanolG78142
Datenbank-Bezeichner
- CAS
127986-84-9- PubChem CID
- 2733810
- DTXSID
DTXSID90370007- EC Number
- 623-946-1
- Nikkaji
- J1.391.967D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,2
- Polarare Oberfläche (TPSA)
- 32,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 471
Physikochemische Eigenschaften
- Schmelzpunkt
- 135 · 135-138 °C(lit.)
- Siedepunkt
- 486.87 °C · 486.87°C (rough estimate)
- Dichte
- 1.1008 · 1.1008 (rough estimate)
- Brechungsindex
- 1.6 · 1.6000 (estimate)
- storage temp.
- 2 · 2-8°C(protect from light)
- Aggregatzustand
- powder
- pka
- 13.01 · 13.01±0.29(Predicted)
- InChI
- 1S/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1
- InChIKey
- LNUDNNFEXRHHGY-DEOSSOPVSA-N
- SMILES
- OC([C@@H]1CCCN1)(c2ccc3ccccc3c2)c4ccc5ccccc5c4
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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]；H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 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.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)；Aquatic Chronic 4 (100%)
Sicherheitsdaten
- wgk
- 3
- risk_code
- 36/37/38-22
- hazard_code
- Xi,Xn
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 OralAquatic Chronic 4Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anbieter22 Anbieter
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
重庆张邦医药科技有限责任公司028-84252981 18583719936 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Chembon Pharmaceutical Co., Ltd.+86-28-8425-2981
career henan chemical co+86-0371-86658258 · [email protected]
北京迈瑞达科技有限公司010-82387566 · [email protected]
Aladdin Scientific[email protected]
安徽英纳威迅科技有限公司0551-62106121 13625641131 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
重庆卡兰医药有限公司[email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Zugehörige Reaktionen
1
Notizen zur Verbindung
Wird geladen…