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1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one

1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one structure

CAS No:
1215-77-6
Formula:
C14H14N2S
Chemical Name:
1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one
Synonyms:
N-Phenylthiocarbamoyl-anthranilonitril; N-2-Tolyl-N'-phenyl-thioharnstoff; N-Phenylcarbamoyl-anthranilonitril; 1-phenyl-3-o-tolyl-thiourea; 1-phenyl 3-o-tolylthiocarbamide; N-Phenyl-N'-o-tolyl-thioharnstoff;Expand

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1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one Basic Attributes

Molecular Weight：

242.33900

Exact Mass：

242.08776963 g/mol

NSC Number：

37120

Characteristics

PSA：

56.15000

XLogP3：

3.94990

Density：

1.249g/cm3

Boiling Point：

358.1ºC

Flash Point：

170.4ºC

Refractive Index：

1.726

Water Solubility：

18.8 [ug/mL]

Vapor Pressure：

2.6E-05mmHg at 25°C

Computed Properties

Molecular Weight:242.34
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:242.08776963
Monoisotopic Mass:242.08776963
Topological Polar Surface Area:56.2
Heavy Atom Count:17
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one

110577-49-6

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Guide of 1-imidazol-1-yl-3,3-dimethyl-2-(2-phenylethyl)butan-1-one

Basic Attributes
Characteristics
Computed Properties
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