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1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE

1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE structure

CAS No:
31964-03-1
Formula:
C7H10N2O
Chemical Name:
1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE
Synonyms:
1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE;2-propanone, 1-(2-methyl-1H-imidazol-1-yl)-;1-(2-methyl-1H-imidazol-1-yl)acetone(SALTDATA: HCl);1-(2-methyl-1-imidazolyl)propan-2-one;1-(2-methylimidazol-1-yl)acetone;1-(2-methylimidazol-1-yl)propan-2-one

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1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE Basic Attributes

Molecular Weight：

138.17

Exact Mass：

138.079312947

DSSTox ID：

DTXSID40432487

Characteristics

PSA：

34.89000

XLogP3：

0.78050

Density：

1.08±0.1 g/cm3

Boiling Point：

278.2±23.0 °C(Predicted)

Flash Point：

122.024ºC

Refractive Index：

1.535

PKA：

7.04±0.31

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:138.17
XLogP3:0.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:138.079312947
Monoisotopic Mass:138.079312947
Topological Polar Surface Area:34.9
Heavy Atom Count:10
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-METHYL-1H-IMIDAZOL-1-YL)ACETONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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