1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Basic Information

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CAS Number

74409-52-2

Molecular Formula

C10H13ClN4O2

Molecular Weight

256.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

144.0 to 148.0 deg-C

Boiling Point

478.2±51.0 °C at 760 mmHg

Density

1.45

Flash Point

243.0±30.4 °C

Refractive Index

1.653

SMILES

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CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCl

InChI

InChI=1S/C10H13ClN4O2/c1-13-6-12-8-7(13)9(16)15(5-3-4-11)10(17)14(8)2/h6H,3-5H2,1-2H3

InChIKey

JMOWKXFNJSTXBW-UHFFFAOYSA-N

LogP

0.06259999999999999

Topological Polar Surface Area

61.82 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

338

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

C10H13ClN4O2
AKOS000121227
1-(3-chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
J-503130
1-(3-Chloropropyl)-3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione
AMY39336
1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione, AldrichCPR
A838116
74409-52-2
SCHEMBL3523033
BCP21861
FT-0641517
1-(3-Chloropropyl)-3,7-dimethylxanthine
1-(3-chloropropyl)-3,7-dimethylpurine-2,6-dione
1-(3-Chloropropyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
DTXSID50515391
AS-11575
1-(3-chloropropyl)-3,7-dimethyl-purine-2,6-dione;1-(3-Chloropropyl)theobromine
MFCD00059926
1-(3-Chloropropyl)-3,7-dimethylxanthine;1-(3-Chloropropyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
1-(3-Chloropropyl)theobromine
Fmoc-(R)-3-Amino-3-(2-chloro-phenyl)-propionicacid
1H-Purine-2,6-dione,1-(3-chloropropyl)-3,7-dihydro-3,7-dimethyl-
Chloropropyltheobromine

MDL Number

MFCD00059926

Customs Code

2933990090

FAQ

What is 1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2)?

1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) is a chemical compound, a purine derivative used in pharmaceutical research and applications.

What are the main uses of 1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2)?

1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) is primarily used as a research tool in the development of new pharmaceuticals, particularly in the study of purine analogs and their potential therapeutic applications.

Is 1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) safe?

1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) is generally safe when handled under appropriate laboratory conditions. However, it should be used with caution, and appropriate protective measures should be taken to avoid skin and respiratory contact.

How should 1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) be stored?

1-(3-Chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS: 74409-52-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation and contamination.