2-Oxa-6-azaspiro[3.3]heptane ethanedioate (1:1)

Basic Information

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CAS Number

1159599-99-1

Molecular Formula

C7H11NO5

Molecular Weight

189.17 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

Basic Physical Properties

Water Solubility

Slightly soluble in water.

SMILES

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C1C2(CN1)COC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C5H9NO.C2H2O4/c1-5(2-6-1)3-7-4-5;3-1(4)2(5)6/h6H,1-4H2;(H,3,4)(H,5,6)

InChIKey

KOUVDKDABFOPIG-UHFFFAOYSA-N

LogP

-1.2381999999999995

Topological Polar Surface Area

95.86 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

154

Safety Information

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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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

SCHEMBL247085
KOUVDKDABFOPIG-UHFFFAOYSA-N
MFCD11976178
Oxalic acid--2-oxa-6-azaspiro[3.3]heptane (1/1)
2-oxa-6-azaspiro[3,3]heptane oxalic acid salt
C7H11NO5
FT-0686477
2-Oxa-6-azaspiro[3.3]heptane Oxalate(1:x)
2-oxa-6-azaspiro[3,3]heptane oxalate
DTXSID20693397
A846150
2-OXA-6-AZASPIRO[3.3]HEPTANE XOXALATE
SB50747
2-OXA-6-AZASPIRO[3.3]HEPTANE, ETHANEDIOATE (1:1)
2-Oxa-6-azaspiro[3.3]heptane oxalate(1:1)
CS-B1362
PB34656
2-oxa-6-aza-spiro[3.3]heptane oxalate salt
SY038460
2-Oxa-6-azaspiro[3.3]heptane oxalic acid salt
SY008876
GS-3820
F2165-0031
2-oxa-6-azaspiro[3.3]heptane; oxalic acid
AKOS015837591
SB50699
2-OXA-6-AZASPIRO[3.3]HEPTANE ETHANEDIOATE
1254966-66-9
2-OXA-6-AZASPIRO[3.3]HEPTANE OXALATE
BCP26304
AM20020002

MDL Number

MFCD11976178

FAQ

What regulatory guidelines apply to 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1)?

The compound 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1) must comply with various regulatory guidelines including the GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for hazardous communication. In the European Union, it must also adhere to REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) regulations. For pharmaceutical uses, FDA and EPA guidelines should be followed to ensure safe handling and labeling.

Are there alternatives to 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1) in synthesis?

In the synthesis of 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1), chemists might explore alternative reagents such as other cyclic ketones or amino acids. Isomers or analogs like 2-aza-6-oxaspiro[3.3]heptane-6-carboxylic acid can be considered, depending on the specific application and required properties.

What is the market or research trend for 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1)?

The market for 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1) is primarily driven by its use in pharmaceuticals and as a precursor in organic synthesis. Research trends indicate increasing interest in its applications as a scaffold for drug discovery and in the development of new materials. Market dynamics suggest steady demand with potential growth in emerging fields such as synthetic biology and biotechnology.

How should waste containing 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1) be handled?

Waste containing 2-Oxa-6-azaspiro[3.3]heptane ethanedioate (CAS: 1159599-99-1) should be collected in appropriate containers and disposed of by incineration or through professional chemical waste disposal services. Proper environmental protection precautions, such as neutralization to reduce toxicity, should be taken. Disposal must comply with local and national regulations to ensure safe and sustainable waste management.