1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one

Basic Information

View in Editor

CAS Number

1021-25-6

Molecular Formula

C13H17N3O

Molecular Weight

231.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

188-191 °C

Boiling Point

479.7℃ at 760 mmHg

Flash Point

243.9°C

Refractive Index

1.5700 (estimate)

SMILES

View in Editor

C1CNCCC12C(=O)NCN2C3=CC=CC=C3

InChI

InChI=1S/C13H17N3O/c17-12-13(6-8-14-9-7-13)16(10-15-12)11-4-2-1-3-5-11/h1-5,14H,6-10H2,(H,15,17)

InChIKey

HTQWGIHCFPWKAS-UHFFFAOYSA-N

LogP

0.7024999999999995

Topological Polar Surface Area

44.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

293

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

1-phenyl-1,3,8-triazaspiro[4,5]-decan-4-one
BCP20803
Spirodecanone;1,3,8-Triazaspiro[4.5]decan-4-one, 1-phenyl-
MFCD00005977
AS-39092
Spirodecanone
1-phenyl -1,3,8-triaza-spiro[4.5]decan-4-one
EINECS 213-819-5
1-phenyl-1,3,8-triaza-spiro[
1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one, >=96.0% (HPLC)
CHEMBL309711
NSC-96918
W-204446
AB00551
AC-6487
SY011190
1-Phenyl-1,3,8-triazaspiro(4,5)decan-4-one
CCG-275144
BDBM50044436
1-phenyl-1,3,8-triazaspiro[4.5]decane-4-one
NSC96918
1021-25-6
1,3,8-Triazaspiro[4.5]decan-4-one, 1-phenyl-
1-Phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
A1791
EN300-15316
SMR000036952
1-phenyl-4-oxo-1,3,8-triazaspiro[4,5]decane
4-oxo-1-phenyl-1,3,8-triazaspiro-[4.5]decane
SCHEMBL219618
1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one

MDL Number

MFCD00005977

Customs Code

2933990090

FAQ

What is 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6)?

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) is a cyclic organic compound with a triazole ring and a phenyl substituent. It is a complex molecule often used in pharmaceuticals and research, featuring a unique structure that can be utilized in various applications.

What are the main uses of 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6)?

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) is primarily used in pharmaceuticals as a precursor for drug development and in research for its unique chemical properties. It can also have applications in the food industry, though it is not commonly used as a food additive.

Is 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) safe?

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) is generally safe when handled with proper precautions. However, users should be aware of potential skin irritation and inhalation risks. Always follow safety guidelines and use appropriate protective equipment.

How should 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) be stored?

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one (CAS: 1021-25-6) should be stored in a dry, cool, and well-ventilated area. Keep it away from direct sunlight and heat sources. Use a sealed container to prevent moisture absorption and ensure the integrity of the compound.