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1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)-

1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)- structure

CAS No:
53544-25-5
Formula:
C8H11NO3
Chemical Name:
1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)-
Synonyms:
1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)-;1-(2-Oxo-1-pyrrolidinyl)-1,3-butanedione;N-Acetoacetyl-2-pyrrolidone;NSC 183758;1-(2-OXOPYRROLIDIN-1-YL)BUTANE-1,3-DIONE

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1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)- Basic Attributes

Molecular Weight：

169.17784

Exact Mass：

169.073898

NSC Number：

183758

DSSTox ID：

DTXSID90306942

HScode：

2933790090

Characteristics

PSA：

54.4

XLogP3：

-0.18

Density：

1.2±0.1 g/cm3

Melting Point：

49-52℃

Boiling Point：

320.4±25.0 °C at 760 mmHg

Flash Point：

150.6±15.5 °C

Refractive Index：

1.502

Computed Properties

Molecular Weight:169.18
XLogP3:0.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:169.07389321
Monoisotopic Mass:169.07389321
Topological Polar Surface Area:54.4
Heavy Atom Count:12
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)-

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

1,3-Butanedione, 1-(2-oxo-1-pyrrolidinyl)-

SDS

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