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N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide

N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide structure

CAS No:
14070-48-5
Formula:
C9H9N5OS
Chemical Name:
N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide
Synonyms:
Acetamide,N-[3-(2,5-dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]-;Acetanilide,3′-(5-mercapto-1H-tetrazol-1-yl)-;N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide;1-(3-Acetamidophenyl)-5-mercaptotetrazole;1-(m-Acetamidophenyl)-5-mercaptotetrazole;1-(3-Acetamidophenyl)-2-tetrazoline-5-thione;FOG 0901
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide Basic Attributes

Molecular Weight：

235.27

Exact Mass：

235.27

EC Number：

237-924-0

DSSTox ID：

DTXSID7065700

HScode：

2933990090

Characteristics

PSA：

111.50000

XLogP3：

0.98240

Appearance：

white to light yellow powder

Density：

1.51±0.1 g/cm3

Melting Point：

201-202 °C

Refractive Index：

1.747

PKA：

14.60±0.70

Safety Information

Packing level：

III

Hazard category：

4.1

Transport codes：

1325

hazard class code：

11-20/21/22-36/37/38

safety instructions：

16-36/37-36-26

Marks：

F;Xn,Xi,Xn,F

GHS Classification：

|Warning|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P280, and P370+P378|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory.|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide Use and Manufacturing

Manufacturing Info：

Acetamide, N-[3-(2,5-dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]-: ACTIVE

Computed Properties

Molecular Weight:235.27
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:235.05278110
Monoisotopic Mass:235.05278110
Topological Polar Surface Area:101
Heavy Atom Count:16
Complexity:332
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide

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N-[3-(5-Mercapto-1H-1,2,3,4-tetraazol-1-yl)phenyl]acetamide

CAS No.: 14070-48-5

Grade: industrial Grade

Content: 98%

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Guide of N-[3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl]acetamide

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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