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5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL

5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL structure

CAS No:
93073-37-1
Formula:
C10H10N2O2S
Chemical Name:
5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL

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5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL Basic Attributes

Molecular Weight：

222.262

Exact Mass：

222.04600

DSSTox ID：

DTXSID30360664

HScode：

2934999090

Characteristics

PSA：

74.9

XLogP3：

1.95770

Density：

1.33g/cm3

Boiling Point：

323.6ºC at 760mmHg

Flash Point：

149.5ºC

Refractive Index：

1.632

Water Solubility：

>33.3 [ug/mL]

Computed Properties

Molecular Weight:222.27
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:222.04629874
Monoisotopic Mass:222.04629874
Topological Polar Surface Area:74.9
Heavy Atom Count:15
Complexity:273
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL

Basic Attributes
Characteristics
Computed Properties

5-(4-METHOXYBENZYL)-1,3,4-OXADIAZOLE-2-THIOL

SDS

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