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4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE

4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE structure

CAS No:
59150-27-5
Formula:
C4H5N5OS
Chemical Name:
4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE
Synonyms:
4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine;4,6-diamino-5-nitroso-1H-pyrimidine-2-thione;NSC677502;2(1H)-Pyrimidinethione,4,6-diamino-5-nitroso-;NSC23592;C4H5N5OS;SCHEMBL7767430;CTK5A9508;DTXSID50388269;ZINC4558963

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4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE Basic Attributes

Molecular Weight：

171.1814

Exact Mass：

171.02100

NSC Number：

677502|23592

DSSTox ID：

DTXSID50388269

HScode：

2933599090

Characteristics

PSA：

138

XLogP3：

1.49000

Density：

2.08g/cm3

Boiling Point：

277ºC at 760mmHg

Flash Point：

121.3ºC

Refractive Index：

1.949

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:171.18
XLogP3:-1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Exact Mass:171.02148097
Monoisotopic Mass:171.02148097
Topological Polar Surface Area:138
Heavy Atom Count:11
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE

Basic Attributes
Characteristics
Safety Information
Computed Properties

4,6-DIAMINO-2-MERCAPTO-5-NITROSOPYRIMIDINE

SDS

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