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2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione

2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione structure

CAS No:
451502-05-9
Formula:
C14H13N3S2
Chemical Name:
2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione
Synonyms:
3H-1,2,4-Triazole-3-thione,2,4-dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-;2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione

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2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

287.4

Exact Mass：

287.40

DSSTox ID：

DTXSID10384661

Characteristics

PSA：

XLogP3：

3.26740

Density：

1.33g/cm3

Boiling Point：

427.6ºC at 760 mmHg

Flash Point：

212.4ºC

Refractive Index：

1.712

Computed Properties

Molecular Weight:287.4
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:287.05508977
Monoisotopic Mass:287.05508977
Topological Polar Surface Area:88
Heavy Atom Count:19
Complexity:364
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

2,4-Dihydro-4-(phenylmethyl)-5-(3-thienylmethyl)-3H-1,2,4-triazole-3-thione

SDS

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