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4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol

4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol structure

CAS No:
129586-32-9
Formula:
C15H18ClN3O
Chemical Name:
4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol
Synonyms:
4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol;SSF-109

Description

SSF-109 is a broad-spectrum fungicide which has protective activity against plant disease. SSF-109 inhibits the biosynthesis of ergosterol at the 14α-demethylation step in Botrytis cinerea[1].

4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol Basic Attributes

Molecular Weight：

291.779

Exact Mass：

291.11400

Characteristics

PSA：

50.9

XLogP3：

3.32450

Density：

1.32g/cm3

Boiling Point：

478.9ºC at 760mmHg

Flash Point：

243.4ºC

Refractive Index：

1.645

Vapor Pressure：

5.56E-10mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

2588

Drug Information

MeSH Entry Terms：

4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol

Computed Properties

Molecular Weight:291.77
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:291.1138399
Monoisotopic Mass:291.1138399
Topological Polar Surface Area:50.9
Heavy Atom Count:20
Complexity:322
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

4-chlorophenyl-2-(1H-1,2,4-triazol-yl)cycloheptanol

SDS

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