3-Amino-2-azepanone

Basic Information

View in Editor

CAS Number

671-42-1

Molecular Formula

C6H12N2O

Molecular Weight

128.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

76.0 to 80.0 deg-C

Boiling Point

172°C/13mmHg

Density

1.031

SMILES

View in Editor

C1CCNC(=O)C(C1)N

InChI

InChI=1S/C6H12N2O/c7-5-3-1-2-4-8-6(5)9/h5H,1-4,7H2,(H,8,9)

InChIKey

BOWUOGIPSRVRSJ-UHFFFAOYSA-N

LogP

-0.38620000000000027

Topological Polar Surface Area

55.12 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

114

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

CHEBI:19471
A1003
3-aminoazepan-2-one
SY005802
D-3-Amino-.epsilon.-caprolactam
NSC-522223
EINECS 211-584-3
SCHEMBL56745
3-Amino-2-azepanone
3-Aminoazepan-2-one, (3RS)-
dl-Alpha-amino-epsilon-caprolactam
AS-19114
A56021
AKOS016050305
MFCD00064475
J-502205
(3RS)-3-Aminoazepan-2-one
FT-0687401
D-(+)-.alpha.-Amino-eta-caprolactam
AB01007700-01
NSC522223
InChI=1/C6H12N2O/c7-5-3-1-2-4-8-6(5)9/h5H,1-4,7H2,(H,8,9)
SY005803
671-42-1
(+/-)-alpha-Aminocaprolactam
AM20090060
EN300-36332
NS00041891
2-aminohexano-6-lactam
3-Amino-2-azepanone HCl
FT-0625427

MDL Number

MFCD00064475

FAQ

What is 3-Amino-2-azepanone (CAS: 671-42-1)?

3-Amino-2-azepanone (CAS: 671-42-1) is a colorless to light yellow liquid with a pungent odor. It is used in pharmaceuticals and research as an intermediate in the synthesis of other compounds. The chemical formula is C7H12N2O.

What are the main uses of 3-Amino-2-azepanone (CAS: 671-42-1)?

3-Amino-2-azepanone (CAS: 671-42-1) is primarily used as an intermediate in the synthesis of pharmaceuticals and research chemicals. It can also be used in the development of new drugs and as a reagent in organic synthesis.

Is 3-Amino-2-azepanone (CAS: 671-42-1) safe?

3-Amino-2-azepanone (CAS: 671-42-1) is generally safe when handled with proper precautions. It is classified as a hazardous chemical and requires appropriate handling and storage to prevent inhalation, skin contact, and ingestion. Protective gloves, goggles, and a fume hood should be used during handling.

How should 3-Amino-2-azepanone (CAS: 671-42-1) be stored?

3-Amino-2-azepanone (CAS: 671-42-1) should be stored in a cool, dry place, protected from light, and at a temperature below 30°C. It should be kept in a tightly closed container to prevent evaporation and contamination. It is also important to store it away from incompatible materials such as acids and oxidizing agents.