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3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE

3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE structure

CAS No:
134796-34-2
Formula:
C9H8ClN3S
Chemical Name:
3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE

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3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE Basic Attributes

Molecular Weight：

225.7

Exact Mass：

225.01300

DSSTox ID：

DTXSID50352102

HScode：

2933990090

Characteristics

PSA：

66.9

XLogP3：

2.75040

Density：

1.43g/cm3

Boiling Point：

420.4ºC at 760 mmHg

Flash Point：

208.1ºC

Refractive Index：

1.664

Vapor Pressure：

2.81E-07mmHg at 25°C

Computed Properties

Molecular Weight:225.70
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:225.0127461
Monoisotopic Mass:225.0127461
Topological Polar Surface Area:66.9
Heavy Atom Count:14
Complexity:173
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE

Basic Attributes
Characteristics
Computed Properties

3-[(4-CHLOROBENZYL)THIO]-1H-1,2,4-TRIAZOLE

SDS

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