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447-00-7,MFCD00665863

Catalog No.:AA00I8DT

447-00-7 | 3-Thio-6-phenyl-2h-1,2,4-triazin-5-one

Pack Size

Purity

Availability

Price(USD)

Quantity

1mg

>95%

1 week

$299.00 $209.00

- +

5mg

>95%

1 week

$319.00 $223.00

- +

10mg

>95%

1 week

$358.00 $250.00

- +

Technical Information
Properties
Literature
Request for Quotation
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Technical Information

Catalog Number:

AA00I8DT

Chemical Name:

3-Thio-6-phenyl-2h-1,2,4-triazin-5-one

CAS Number:

447-00-7

Molecular Formula:

C9H7N3OS

Molecular Weight:

205.2364

MDL Number:

MFCD00665863

SMILES:

Sc1[nH]nc(c(=O)n1)c1ccccc1

Properties

Computed Properties

Complexity:

294

Covalently-Bonded Unit Count:

1

Defined Atom Stereocenter Count:

0

Defined Bond Stereocenter Count:

0

Formal Charge:

0

Heavy Atom Count:

14

Hydrogen Bond Acceptor Count:

3

Hydrogen Bond Donor Count:

2

Isotope Atom Count:

0

Rotatable Bond Count:

1

Undefined Atom Stereocenter Count:

0

Undefined Bond Stereocenter Count:

0

XLogP3:

1.3

Literature

Title: Two regioisomers of condensed thioheterocyclic triazine synthesized from 6-phenyl-3-thioxo-2,3,4,5-tetrahydro-1,2,4-triazin-5-one.

Journal: Acta crystallographica. Section C, Crystal structure communications 20091201

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SDS

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Tags:447-00-7 Molecular Formula|447-00-7 MDL|447-00-7 SMILES|447-00-7 3-Thio-6-phenyl-2h-1,2,4-triazin-5-one

Catalog No.: AA00I8DT

447-00-7,MFCD00665863

447-00-7 | 3-Thio-6-phenyl-2h-1,2,4-triazin-5-one

Pack Size： 1mg

Purity： >95%

1 week

$299.00 $209.00

Pack Size： 5mg

Purity： >95%

1 week

$319.00 $223.00

Pack Size： 10mg

Purity： >95%

1 week

$358.00 $250.00

Quantity

- +

Add to Card

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bulk Quotation Request

Technical Information

Catalog Number: AA00I8DT

Chemical Name: 3-Thio-6-phenyl-2h-1,2,4-triazin-5-one

CAS Number: 447-00-7

Molecular Formula: C9H7N3OS

Molecular Weight: 205.2364

MDL Number: MFCD00665863

SMILES: Sc1[nH]nc(c(=O)n1)c1ccccc1

Properties

Complexity: 294

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 14

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 2

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.3

Literature fold

Title: Two regioisomers of condensed thioheterocyclic triazine synthesized from 6-phenyl-3-thioxo-2,3,4,5-tetrahydro-1,2,4-triazin-5-one.

Journal: Acta crystallographica. Section C, Crystal structure communications20091201

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