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4-(4-Chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-1,3-bu tanediol

4-(4-Chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-1,3-bu tanediol structure

CAS No:
72699-18-4
Formula:
C14H18ClN3O3
Chemical Name:
4-(4-Chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-1,3-bu tanediol
Synonyms:
4-(4-chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)butan-1,3-diol; 4-(4-chlorophanyl)piperidine; 4-(p-chlorophenyl)piperidine; 4-chlorophenylpiperidine; Piperidine,4-(4-chlorophenyl); 4-(4-chlorophenyl) piperidine; 1-(4-chlorophenoxy)-1-(1,2,4-triazol-1-yl)-3,3-dimethyl-butane-2,4-diol; 4-(4-chloro-phenoxy)-2,2-dimethyl-4-[1,2,4]triazol-1-yl-butane-1,3-diol;Expand

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4-(4-Chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-1,3-bu tanediol Basic Attributes

Molecular Weight：

311.76400

Exact Mass：

311.1036691

Characteristics

PSA：

80.40000

XLogP3：

1.88850

Density：

1.32g/cm3

Boiling Point：

534.6ºC

Flash Point：

277.1ºC

Refractive Index：

1.594

Drug Information

MeSH Entry Terms：

Bay KWG 1342

Computed Properties

Molecular Weight:311.76
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:311.1036691
Monoisotopic Mass:311.1036691
Topological Polar Surface Area:80.4
Heavy Atom Count:21
Complexity:325
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(4-Chlorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-1,3-bu tanediol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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