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5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione

5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione structure

CAS No:
91129-85-0
Formula:
C10H11N3S2
Chemical Name:
5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione
Synonyms:
1,3,4-Thiadiazole-2(3H)-thione,5-[(2-phenylethyl)amino]-;1,3,4-Thiadiazole-2-thiol,5-(phenethylamino)-;5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione

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5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione Basic Attributes

Molecular Weight：

237.339

Exact Mass：

237.34

DSSTox ID：

DTXSID00387808

HScode：

2934999090

Characteristics

PSA：

93.8

XLogP3：

2.55440

Density：

1.36g/cm3

Melting Point：

146-148 °C

Boiling Point：

364.3ºC at 760mmHg

Flash Point：

174.1ºC

Refractive Index：

1.708

Computed Properties

Molecular Weight:237.3
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:237.03943971
Monoisotopic Mass:237.03943971
Topological Polar Surface Area:93.8
Heavy Atom Count:15
Complexity:259
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione

Basic Attributes
Characteristics
Computed Properties

5-[(2-Phenylethyl)amino]-1,3,4-thiadiazole-2(3H)-thione

SDS

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