3-Methyl-1-phenyl-1H-pyrazol-5-amine | CAS No. 1131-18-6

3-Methyl-1-phenyl-1H-pyrazol-5-amine

Basic Information

CAS Number

1131-18-6

Molecular Formula

C10H11N3

Molecular Weight

173.22 g/mol

EINECS

214-463-3

AD

Basic Physical Properties

Melting Point

113.0 to 117.0 deg-C

Boiling Point

333°C

Density

1.2894 (rough estimate)

Water Solubility

6.051g/L at 25℃

Flash Point

155.2℃

Refractive Index

1.6250 (estimate)

Vapor Pressure

0.006Pa at 25℃

CC1=NN(C(=C1)N)C2=CC=CC=C2

InChI

InChI=1S/C10H11N3/c1-8-7-10(11)13(12-8)9-5-3-2-4-6-9/h2-7H,11H2,1H3

InChIKey

FMKMKBLHMONXJM-UHFFFAOYSA-N

LogP

1.7629199999999998

pKa

3.88±0.10(Predicted)

Topological Polar Surface Area

43.84 Ų

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

166

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Storage Conditions

Keep in dark place,Inert atmosphere,Room temperature

Toxicity

mouse,LD50,oral,1300mg/kg (1300mg/kg),BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS",Personal Communication from LONZA Ltd., CH-4002, Basel, SwitzerlandVol. 03FEB1981,

RTECS

UQ4990000

Synonyms & References

English

  • 1H-Pyrazol-5-amine, 3-methyl-1-phenyl-
  • 1131-18-6
  • 3-AMINO-5-METHYL-2-PHENYL-2H-PYRAZOLE
  • CS-W017549
  • FT-0616043
  • NCGC00255781-01
  • AB01287
  • 3-Methyl-1-phenylpyrazol-5-ylamine
  • InChI=1/C10H11N3/c1-8-7-10(11)13(12-8)9-5-3-2-4-6-9/h2-7H,11H2,1H3
  • CDS1_000057
  • A1311
  • Pyrazole, 5-amino-3-methyl-1-phenyl-
  • W-108626
  • EINECS 214-463-3
  • AMY6959
  • HMS2311H18
  • BRN 0140666
  • STR07933
  • F3095-4785
  • NS00023674
  • CAS-1131-18-6
  • FMKMKBLHMONXJM-UHFFFAOYSA-
  • Z55423087
  • 1-phenyl-3-methyl-5-pyrazolamine
  • Tox21_301945
  • EN300-02206
  • Q27293590
  • 1H-Pyrazole-5-amine, 3-methyl-1-phenyl-
  • Cambridge id 5108082
  • SDCCGMLS-0046251.P002
  • CHEMBL1604278

MDL Number

MFCD00020727

EC Number

214-463-3

Customs Code

2933199090

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