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2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE

2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE structure

CAS No:
338751-47-6
Formula:
C4H5N5S
Chemical Name:
2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE
Synonyms:
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetonitrile;2-[(5-Amino-1H-1,2,4-triazol-3-yl)sulfanyl]-acetonitrile;[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetonitrile;C4H5N5S;CTK7D0698;DTXSID00365429;KS-00001X9V;ZINC2241721;0741AE;0742AE

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2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE Basic Attributes

Molecular Weight：

155.18

Exact Mass：

155.027

DSSTox ID：

DTXSID00365429

HScode：

2933990090

Characteristics

PSA：

117

XLogP3：

0.3

Melting Point：

130-133°C

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:155.18
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:155.02656635
Monoisotopic Mass:155.02656635
Topological Polar Surface Area:117
Heavy Atom Count:10
Complexity:151
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-[(5-AMINO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETONITRILE

SDS

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