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4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA

4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA structure

CAS No:
886499-48-5
Formula:
C9H9N5S
Chemical Name:
4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA
Synonyms:
4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA;1-(4-(1,2,4-TRIAZOLYL)PHENYL))THIOUREA;Thiourea, N-[4-(1H-1,2,4-triazol-1-yl)phenyl]-

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4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA Basic Attributes

Molecular Weight：

219.27

Exact Mass：

219.05786648

Characteristics

Density：

1.45±0.1 g/cm3

Melting Point：

243-245°C

Boiling Point：

427.6±55.0 °C(Predicted)

PKA：

12.57±0.70

Computed Properties

Molecular Weight:219.27
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:219.05786648
Monoisotopic Mass:219.05786648
Topological Polar Surface Area:101
Heavy Atom Count:15
Complexity:227
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(1,2,4-TRIAZOL-1-YL)PHENYLTHIOUREA

Basic Attributes
Characteristics
Computed Properties

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