O6-[4-(Aminomethyl)benzyl]guanine

Basic Information

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CAS Number

674799-96-3

Molecular Formula

C13H14N6O

Molecular Weight

270.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

>240°C(dec.)

Density

1.433±0.06 g/cm3 (20 ºC 760 Torr)

Refractive Index

1.748

SMILES

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C1=CC(=CC=C1CN)COC2=NC(=NC3=C2NC=N3)N

InChI

InChI=1S/C13H14N6O/c14-5-8-1-3-9(4-2-8)6-20-12-10-11(17-7-16-10)18-13(15)19-12/h1-4,7H,5-6,14H2,(H3,15,16,17,18,19)

InChIKey

UINSGVKWAFJDPI-UHFFFAOYSA-N

LogP

0.9728000000000001

Topological Polar Surface Area

115.73 Å²

Hydrogen Bond Donor/Acceptor

5 / 7

Complexity

309

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

O-[4-(Aminomethyl)benzyl]guanine
MFCD07367624
FT-0661897
1H-Purin-2-amine, 6-[[4-(aminomethyl)phenyl]methoxy]-
AKOS016006014
DS-14699
LCZC340
SY047354
RB3273
C13H14N6O
MFCD22577247
BCP23591
O6-[4-(Aminomethyl)benzyl]guanine
6-(4-(aminomethyl)benzyloxy)-9H-purin-2-amine
AMY20691
A867259
6-[[4-(Aminomethyl)phenyl]methoxy]-1H-purin-2-amine
6-((4-(Aminomethyl)benzyl)oxy)-9H-purin-2-amine
CHEMBL520064
6-((4-(Aminomethyl)benzyl)oxy)-7H-purin-2-amine
CS-W018562
SCHEMBL23124359
AKOS028109098
674799-96-3
6-[[4-(AMinoMethyl)phenyl]Methoxy]-1H-purin-2-aMine 6-((4-(AMinoMethyl)benzyl)oxy)-7H-purin-2-aMine 6-[[4-(Aminomethyl)phenyl]methoxy]-7H-purin-2-amine
PD135993
6-[[4-(aminomethyl)phenyl]methoxy]-7H-purin-2-amine
SCHEMBL3720508
6-[[4-(AMinoMethyl)phenyl]Methoxy]-1H-purin-2-aMine
6-[[4-(Aminomethyl)phenyl]methoxy]-7H-purin-2-amine
O6-(4-aminomethyl)benzylguanine

MDL Number

MFCD07367624

Customs Code

2933990090

FAQ

What is O6-[4-(Aminomethyl)benzyl]guanine (CAS: 674799-96-3)?

O6-[4-(Aminomethyl)benzyl]guanine is a guanine derivative with a substituent at position O6. It is an organic compound with potential in the field of cancer research and therapy.

What are the main uses of O6-[4-(Aminomethyl)benzyl]guanine (CAS: 674799-96-3)?

O6-[4-(Aminomethyl)benzyl]guanine is primarily used in cancer research and therapy, particularly as a DNA alkylating agent in the treatment of certain types of cancer. It has also shown potential for use in other medical research applications.

Is O6-[4-(Aminomethyl)benzyl]guanine (CAS: 674799-96-3) safe?

O6-[4-(Aminomethyl)benzyl]guanine is generally considered safe when used as directed in medical settings, but it is important to follow all safety guidelines, including wearing appropriate personal protective equipment and handling in a secure laboratory setting. Care must be taken to avoid contact with skin and eyes.

How should O6-[4-(Aminomethyl)benzyl]guanine (CAS: 674799-96-3) be stored?

O6-[4-(Aminomethyl)benzyl]guanine should be stored in a cool, dry place at temperatures below 25°C (77°F) to maintain stability. It should be kept away from direct sunlight and in a tightly sealed container to prevent degradation. Proper ventilation should be ensured during storage and handling.