RS-127445 | CAS No. 199864-87-4

RS-127445

Basic Information

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CAS Number

199864-87-4

Molecular Formula

C17H16FN3

Molecular Weight

281.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

472.8°C at 760 mmHg

Density

1.213

SMILES

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NC1=NC(C(C)C)=CC(C2=C3C=CC=CC3=C(F)C=C2)=N1

InChI

InChI=1S/C17H16FN3/c1-10(2)15-9-16(21-17(19)20-15)13-7-8-14(18)12-6-4-3-5-11(12)13/h3-10H,1-2H3,(H2,19,20,21)

InChIKey

ZZZQXCUPAJFVBN-UHFFFAOYSA-N

LogP

4.141500000000002

Topological Polar Surface Area

51.8 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

349

Safety Information

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Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Storage Conditions

Inert atmosphere,2-8°C

Synonyms & References

English

RS-127,445
4-(4-Fluoronaphthalen-1-yl)-6-isopropylpyrimidin-2-amine
4-(4-Fluoronaphthalen-1-yl)-6-isopropylpyrimidin-2-amine hydrochloride
RS 127445
RS 127445 hydrochloride
RS 127445 hydrochloride,4-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinaminehydrochloride
4-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinaminehydrochloride
MT500
RS-127445 hydrochloride
4-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinamine
RS-127445HCl
2-Amino-4-(4-fluoronaphth-1-yl)-6-isopropylpyrimidine
2-PyriMidinaMine, 4-(4-fluoro-1-naphthalenyl)-6-(1-Methylethyl)-
MT 500
0JAU3P8OBM
C17H16FN3
RS127445
AK112028
4-(4-fluoronaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-amine
GTPL188
RS 127445 hydrochloride/
ZZZQXCUPAJFVBN-UHFFFAOYSA-N
HMS3651H11
BCPP000085
BCP027
4-(4-FLUORO-1-NAPHTHALENYL)-6-(1-METHYLETHYL)-2-PYRIMIDINAMINE HYDROCHLORIDE
RS 127445 HYDROCHLORIDE
4-(4-Fluoronaphthalen-1-yl)-6-isopropylpyriMidin-2-aMine hydrochloride

MDL Number

MFCD20270616

FAQ

What are the physical and chemical properties of RS-127445 (CAS: 199864-87-4)?

RS-127445 is a crystalline compound with a molecular weight of approximately 436.34 g/mol. It has a high solubility in organic solvents such as DMSO and ethanol. Chemically, it is relatively stable but can react with strong acids or bases. It is used in drug discovery and research.

How is RS-127445 (CAS: 199864-87-4) typically synthesized?

RS-127445 is synthesized through a multi-step process involving condensation and amide formation reactions. Commonly, it is prepared using protected intermediates, and the final product is obtained with good yield and selectivity. The synthesis involves the use of common organic solvents and standard laboratory techniques.

What industries use RS-127445 (CAS: 199864-87-4)?

RS-127445 is primarily used in the pharmaceutical industry for drug discovery and development. It is also of interest in research related to neuropharmacology and potentially in other areas such as sensor technology and material science.

What precautions should be taken when handling RS-127445 (CAS: 199864-87-4)?

Proper handling of RS-127445 requires the use of personal protective equipment (PPE) such as gloves, lab coat, and safety glasses. It should be stored in a dry, cool, and well-ventilated area away from direct sunlight. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.