tert-Butyl 1,6-diazaspiro[3.4]octane-6-carboxylate

6-Boc-1,6-diazaspiro[3.4]... · 6-Boc-1,6-diazaspiro[3.4]octane · 7-Boc-1,7-diaza-spiro[3.5]nonane oxalate · 6-Boc-1,6-diazaspiro[3.4]octane heMioxalate · Tert-butyl 1,7-diazaspiro[3.4]octane-7-carboxylate · 1,6-Diazaspiro[3.4]octan-6-carboxylic acid tert-butyl ester · 1,6-Diazaspiro[3.4]octane-6-carboxylic acid tert-butyl ester · 1,6-Diazaspiro[3.4]octane-6-carboxylic acid tert-butyl ester - D5979

https://huagongshe.com/de/chemical/53484530

Molekülstruktur von tert-Butyl 1,6-diazaspiro[3.4]octane-6-carboxylate

Identifikatoren & physikalische Daten

CAS No.	1158749-79-1
Summenformel	C11H20N2O2
Durchschnittliche Molmasse	212,29 g/mol
Monoisotopische Masse	212,15247789 g/mol
SMILES	CC(C)(C)OC(=O)N1CCC2(CCN2)C1
InChIKey	HXUGSDLGHNRSJZ-UHFFFAOYSA-N
PubChem CID	53484530
EC No.	961-655-4
DTXSID	DTXSID20704073

Chemische & physikalische Eigenschaften

XLogP	0,8
Polarare Oberfläche (TPSA)	41,6
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	2
Schwere Atome	15
Formalladung	0
Komplexität	272
Siedepunkt	301.3±15.0 °C(Predicted)
Dichte	1.10±0.1 g/cm3(Predicted)
Lagerbedingungen	2-8°C(protect from light)
pKa (Säurekonstante)	10.72±0.20(Predicted)
InChI	InChI=1S/C11H20N2O2/c1-10(2,3)15-9(14)13-7-5-11(8-13)4-6-12-11/h12H,4-8H2,1-3H3
InChIKey	HXUGSDLGHNRSJZ-UHFFFAOYSA-N
SMILES	N1C2(CCN(C(OC(C)(C)C)=O)C2)CC1

Sicherheit & Vorschriften

GHS-Einstufung	DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Zollcode	2933998090