CAS No.336191-17-4,2,8-DIAZA-SPIRO[4.5]DECANE-2-CARBOXYLIC ACID TERT-BUTYL ESTER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	336191-17-4
Name:	2,8-DIAZA-SPIRO[4.5]DECANE-2-CARBOXYLIC ACID TERT-BUTYL ESTER
Article Data:	6

Formula:	C₁₃H₂₄N₂O₂
Molecular Weight:	240.346
Synonyms:	2,8-Diazaspiro[4.5]decane-2-carboxylicacid tert-butyl ester;2,8-Diazaspiro[4.5]decane-2-carboxylic acid tert-butylester;
Density:	1.07 g/cm³
Boiling Point:	337 °C at 760 mmHg
Flash Point:	157.6 °C
Risk Codes:	20-22-36/37/38
Safety:	26-36
PSA:	41.57000
LogP:	2.26370

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Specification

The CAS register number of 2,8-Diazaspiro[4.5]decane-2-carboxylicacid, 1,1-dimethylethyl ester is 336191-17-4. It also can be called as 2,8-Diazaspiro[4.5]decane-2-carboxylicacid tert-butyl ester and the systematic name about this chemical is tert-butyl 2,8-diazaspiro[4.5]decane-2-carboxylate. The molecular formula about this chemical is C₁₃H₂₄N₂O₂ and the molecular weight is 240.34.

Physical properties about 2,8-Diazaspiro[4.5]decane-2-carboxylicacid, 1,1-dimethylethyl ester are: (1)ACD/LogP: 1.46; (2)#H bond acceptors: 4; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 41.57 Å²; (6)Index of Refraction: 1.514; (7)Molar Refractivity: 67.55 cm³; (8)Molar Volume: 224 cm³; (9)Polarizability: 26.78x10^-24cm³; (10)Surface Tension: 40.2 dyne/cm; (11)Density: 1.07 g/cm³; (12)Flash Point: 157.6 °C; (13)Enthalpy of Vaporization: 58.02 kJ/mol; (14)Boiling Point: 337 °C at 760 mmHg; (15)Vapour Pressure: 0.000108 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N2CCC1(CCNCC1)C2
(2)InChI: InChI=1/C13H24N2O2/c1-12(2,3)17-11(16)15-9-6-13(10-15)4-7-14-8-5-13/h14H,4-10H2,1-3H3
(3)InChIKey: NFNCPNAVNRBDOU-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-9-6-13(10-15)4-7-14-8-5-13/h14H,4-10H2,1-3H3
(5)Std. InChIKey: NFNCPNAVNRBDOU-UHFFFAOYSA-N