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4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate

4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate structure

CAS No:
65802-56-4
Formula:
C4H7N3O2S
Chemical Name:
4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate
Synonyms:
4-amino-6-hydroxy-2-pyrimidinethiomonohydrate;2-MERCAPTO-4-AMINO-6-HYDROXYPYRIMIDINE MONOHYDRATE;4-AMINO-6-HYDROXY-2-MERCAPTOPYRIMIDINE HYDRATE;4-AMINO-6-HYDROXY-2-MERCAPTOPYRIMIDINE MONOHYDRATE;4-AMINO-6-HYDROXY-2-THIOPYRIMIDINE MONOHYDRATE;4-AMINO-6-HYDROXYPYRIMIDINE-2-THIOLHYDRATE;6-AMINO-6-HYDROXYPYRIMIDINE-2-THIOLHYDRATE;6-AMINO-2-THIOURACIL HYDRATE
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

Off-White Solid

4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate Basic Attributes

Molecular Weight：

161.18

Exact Mass：

161.025894

BRN：

5795441

EC Number：

251-501-8

DSSTox ID：

DTXSID20215992

HScode：

2933599090

Characteristics

PSA：

100

XLogP3：

0.53160

Appearance：

off-white solid

Melting Point：

>300 °C(lit.)

Boiling Point：

557°C at 760 mmHg

Flash Point：

290.7ºC

Water Solubility：

Soluble in water and DMSO.

Storage Conditions：

Refrigerator

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

22-36

safety instructions：

26-24/25

RTECS Number：

UW0495000

Marks：

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P305 + P351 + P338

Hazard Statements：

H302-H319

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate Use and Manufacturing

Derivatives of 6-Amino-2-thiouracil as novel, potent, and selective A3 adenosine receptor antagonists.

Computed Properties

Molecular Weight:161.19
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Exact Mass:161.02589765
Monoisotopic Mass:161.02589765
Topological Polar Surface Area:100
Heavy Atom Count:10
Complexity:198
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Material

Ethyl cyanoacetate

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Guide of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
Latest News
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4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate

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