2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate

Basic Information

View in Editor

CAS Number

236406-55-6

Molecular Formula

C12H22N2O2

Molecular Weight

226.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Boiling Point

319.4°C at 760 mmHg

Density

1.08

Flash Point

147°C

Refractive Index

1.517

SMILES

View in Editor

CC(C)(C)OC(=O)N1CC2(C1)CCNCC2

InChI

InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-8-12(9-14)4-6-13-7-5-12/h13H,4-9H2,1-3H3

InChIKey

HWLNKJXLGQVMJH-UHFFFAOYSA-N

LogP

1.6068999999999998

Topological Polar Surface Area

41.57 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

269

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

2,7-Diazaspiro[3.5]nonane-2-carboxylic acid,1,1-dimethylethyl ester
W-205210
HWLNKJXLGQVMJH-UHFFFAOYSA-N
F8887-3843
tert-butyl 2,7-diazaspiro[3.5]-nonane-2-carboxylate
2,7-Diazaspiro[3.5]nonane-2-carboxylic acid, 1,1-dimethylethyl ester
EN300-73843
2,7-Diazaspiro3.5nonane-2-carboxylic acid tert-butyl ester
2,7-Diazaspiro[3.5]nonane-2-carboxylic acid tert-butyl ester
AM20090257
SB10181
2-BOC-2,7-DIAZASPIRO[3.5]NONANE
tert-butyl 2,7-diazaspiro[3.5]nonane-2-carboxylate
BP-11953
2-(tert-Butoxycarbonyl)-2,7-diazaspiro[3.5]nonane, AldrichCPR
A4935
MFCD09834803
FT-0602192
AKOS015838354
SCHEMBL484569
2-(tert-Butoxycarbonyl)-2,7-diazaspiro[3.5]nonane
2-Boc-2,7-diaza-spiro[3.5]nonane
BCP23994
DS-10482
Z1123686400
DTXSID40632526
236406-55-6
CS-D0149
2,7-diaza-spiro[3.5]nonane-2-carboxylic acid tert-butyl ester
SY027594
2,7-Diaza-spiro[3.5]nonane-2-carbox

MDL Number

MFCD09834803

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6)?

2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6) is a crystalline compound with a molecular weight of approximately 222.3 g/mol. It has a low solubility in water but good solubility in organic solvents like methanol and dichloromethane. The compound is moderately reactive, particularly towards nucleophiles and can undergo ester hydrolysis under acidic conditions. It exists as a single crystalline form under standard conditions.

How is 2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6) typically synthesized?

2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6) is typically synthesized via a multistep process involving the preparation of a diazabicycloheptane intermediate, followed by esterification with 2-methyl-2-propanol. The synthesis involves standard laboratory techniques and can be carried out using mild conditions, yielding a high purity product with good selectivity and a yield of about 85%.

What industries use 2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6)?

2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6) is used in the pharmaceutical industry for the synthesis of certain drug molecules due to its unique structural features. It can also find applications in the polymer industry for developing functional polymers and in the sensor industry for use in selective chemical sensors.

What precautions should be taken when handling 2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6)?

When handling 2-Methyl-2-propanyl 2,7-diazaspiro[3.5]nonane-2-carboxylate (CAS: 236406-55-6), it is important to use personal protective equipment (PPE) such as gloves, goggles, and lab coats. Work should be carried out in a well-ventilated area or fume hood to avoid inhalation of any fumes. Spills should be cleaned up immediately using appropriate spill kits. Always consult the Safety Data Sheet (SDS) for proper handling and disposal instructions.