2-(chloromethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine|89567-04-4,AngeneChemical

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Pyrimidine, 5-bromo-2-methyl-

1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide

2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-

O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]

Tris(dibenzylideneacetone)dipalladium

C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C

Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

2-(chloromethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine

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Chemical Name:	2-(chloromethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CAS Number:	89567-04-4
Product Number:	AG003Y3G(AGN-PC-0KBPGE)
Synonyms:
MDL No:	MFCD00512744
Molecular Formula:	C11H12ClN3S
Molecular Weight:	253.7511

Identification/Properties
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Identification/Properties

Computed Properties

Molecular Weight:

253.748g/mol

XLogP3:

2.9

Hydrogen Bond Donor Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

Exact Mass:

253.044g/mol

Monoisotopic Mass:

253.044g/mol

Topological Polar Surface Area:

80A^2

Heavy Atom Count:

Formal Charge:

Complexity:

266

Isotope Atom Count:

Defined Atom Stereocenter Count:

Undefined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Undefined Bond Stereocenter Count:

Covalently-Bonded Unit Count:

Compound Is Canonicalized:

Yes

Safety Information

GHS Pictogram:

N/A

Signal Word:

UN#:

Hazard Statements:

Precautionary Statements:

Class:

Packing Group:

NMR Spectrum

Other Analytical Data

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Chemical Structure

2-(Chloromethyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-amine plays a crucial role in chemical synthesis as a versatile building block. Its reactive chloromethyl group allows for selective and efficient functionalization reactions, making it a valuable intermediate in the synthesis of various organic compounds. This compound can be utilized in the creation of complex molecular structures, including pharmaceuticals, agrochemicals, and materials for industrial applications. Its unique structure and reactivity make it a valuable tool for researchers and chemists seeking to develop novel molecules with specific properties and functions.