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3-Amino-2-piperidinone

3-Amino-2-piperidinone structure

CAS No:
1892-22-4
Formula:
C5H10N2O
Chemical Name:
3-Amino-2-piperidinone
Synonyms:
2-Piperidinone,3-amino-;2-Piperidone,3-amino-;3-Amino-2-piperidinone;Ornithine,N5-lactam;3-Amino-2-piperidone;4077-38-7
Categories:
Organic Chemistry > Nitrogen Compounds

Description

Slightly pale yellow to yellow crystal or powder

Solid

3-aminopiperidine-2-one is a delta-lactam that is 2-piperidone substituted at position 3 by an amino group. It has a role as a human metabolite. It is a member of piperidones, a primary amino compound and a delta-lactam.

3-Amino-2-piperidinone Basic Attributes

Molecular Weight：

114.15

Exact Mass：

114.15

DSSTox ID：

DTXSID30409421

HScode：

29333990

Characteristics

PSA：

55.1

XLogP3：

-0.8

Appearance：

Solid

Density：

1.071±0.06 g/cm3(Predicted)

Boiling Point：

125-135 °C @ Press: 2-3 Torr

Flash Point：

139.8±25.9 °C

Refractive Index：

1.477

Storage Conditions：

-20°C

Safety Information

Hazard category：

IRRITANT

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

3-amino-2-piperidone

3-Amino-2-piperidinone Use and Manufacturing

To a stirred solution of To a solution of 4-fluoroisobenzofuran-1, 3-dione (661 mg, 3.98 mmol, CAS652-39-1), KOAc (1.21 g, 12.3 mmol) in HOAc (30 mL) was added

Computed Properties

Molecular Weight:114.15
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:114.079312947
Monoisotopic Mass:114.079312947
Topological Polar Surface Area:55.1
Heavy Atom Count:8
Complexity:103
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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