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4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione

4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione structure

CAS No:
436092-66-9
Formula:
C12H13N7S
Chemical Name:
4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione
Synonyms:
3H-1,2,4-Triazole-3-thione,4-ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-;4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione

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4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

287.34

Exact Mass：

287.34

DSSTox ID：

DTXSID80357680

HScode：

2933990090

Characteristics

PSA：

103

XLogP3：

1.28850

Density：

1.48g/cm3

Boiling Point：

452.1ºC at 760 mmHg

Flash Point：

227.2ºC

Refractive Index：

1.772

Water Solubility：

23.5 [ug/mL]

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:287.35
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:287.09531462
Monoisotopic Mass:287.09531462
Topological Polar Surface Area:103
Heavy Atom Count:20
Complexity:393
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-Ethyl-2,4-dihydro-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-1,2,4-triazole-3-thione

SDS

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