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6-Aza-2-thiothymine

6-Aza-2-thiothymine structure

CAS No:
615-76-9
Formula:
C4H5N3OS
Chemical Name:
6-Aza-2-thiothymine
Synonyms:
1,2,4-Triazin-5(2H)-one,3,4-dihydro-6-methyl-3-thioxo-;as-Triazine-3,5(2H,4H)-dione,6-methyl-3-thio-;as-Triazin-5-ol,3-mercapto-6-methyl-;3,4-Dihydro-6-methyl-3-thioxo-1,2,4-triazin-5(2H)-one;5-Methyl-2-thio-6-azauracil;2-Thio-6-azathymine;3-Mercapto-5-hydroxy-6-methyl-1,2,4-triazine;6-Aza-2-thiothymine;NSC 102906;NSC 1609;NSC 38618;3-Mercapto-6-methyl-1,2,4-triazin-5-ol;3-Mercapto-6-methyl-1,2,4-triazin-5(4H)-one;452-87-9;7338-83-2
Categories:
Biochemical Engineering > Nucleoside Drugs

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Description

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6-Aza-2-thiothymine Basic Attributes

Molecular Weight：

143.17

Exact Mass：

143.17

BRN：

4861

EC Number：

210-445-4

UNII：

RHH0RIO9KF

NSC Number：

102906|38618|1609

DSSTox ID：

DTXSID30210473

HScode：

2933699090

Characteristics

PSA：

85.6

XLogP3：

0.13590

Density：

1.63g/cm3

Melting Point：

218-219 °C @ Solvent: Water

Boiling Point：

356.4ºC at 760 mmHg

Flash Point：

169.4ºC

Refractive Index：

1.749

Water Solubility：

soluble in water (partly), and formic acid (5 %).

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

20/21/22-11

safety instructions：

36/37/39-26-22-16

RTECS Number：

XZ2853000

Marks：

Precautionary statement(s)：

P264, P270, P280, P301+P312, P302+P352, P312, P322, P330, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-thio-6-azathymine

6-Aza-2-thiothymine Use and Manufacturing

Synthetic Polymer MALDI Matrix Compounds

Computed Properties

Molecular Weight:143.17
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:143.01533297
Monoisotopic Mass:143.01533297
Topological Polar Surface Area:85.6
Heavy Atom Count:9
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Thiouridine Formula

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5-Fluorouridine Formula

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N4-BENZOYL-2'-O-METHYLCYTIDINE Formula

52571-45-6
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3′-O-Methyladenosine Structure

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What is 3′-O-Methylguanosine

10300-27-3
What is CCPA

37739-05-2

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Guide of 6-Aza-2-thiothymine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

6-Aza-2-thiothymine

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