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Methyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate
[CAS 895042-62-3]

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ChemBridge Corporation USA
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Fluorochem Ltd. UK
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Princeton BioMolecular Research, Inc. USA
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Vitas-M Russian Federation
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Chemical manufacturer since 1998
Identification
Name Methyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate
Synonyms methyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate; MFCD06135850
Molecular Structure CAS#: 895042-62-3, Methyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate
Molecular Formula C12H13N3O2
Molecular Weight 231.25
CAS Registry Number 895042-62-3
SMILES O=C(OC)c2ccc(n1nc(cc1N)C)cc2
InChI 1S/C12H13N3O2/c1-8-7-11(13)15(14-8)10-5-3-9(4-6-10)12(16)17-2/h3-7H,13H2,1-2H3
InChIKey VDVAPLGNGFCWJH-UHFFFAOYSA-N
Properties
Density 1.263g/cm3 (Cal.)
Boiling point 404.029°C at 760 mmHg (Cal.)
Flash point 198.15°C (Cal.)
Refractive index 1.61 (Cal.)
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