Cas no 181585-93-3 (Methyl 5-nitro-1H-pyrazole-3-carboxylate)

Methyl 5-nitro-1H-pyrazole-3-carboxylate structure
181585-93-3 structure
Product Name:Methyl 5-nitro-1H-pyrazole-3-carboxylate
CAS No:181585-93-3
MF:C5H5N3O4
MW:171.110900640488
MDL:MFCD08236713
CID:138629
PubChem ID:135452337
Update Time:2025-04-19

Methyl 5-nitro-1H-pyrazole-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 5-nitro-1H-pyrazole-3-carboxylate
    • 1H-Pyrazole-3-carboxylicacid, 5-nitro-, methyl ester
    • 5-Nitro-1H-Pyrazole-3-Carboxylic Acid Methyl Ester
    • METHYL 3-NITRO-1H-PYRAZOLE-5-CARBOXYLATE
    • 5-nitro-2H-pyrazole-3-carboxylic acid methyl ester
    • methyl 3-nitropyrazole-5-carboxylate
    • Methyl 5-nitropyrazole-3-carboxylate
    • methyl 5-nitropyrazole-3-carbo
    • 3-Methoxycarbonyl-5-nitropyrazole
    • methyl 5-nitro-2H-pyrazole-3-carboxylate
    • 5-nitro-3-pyrazolecarboxylic acid Methyl ester
    • 5-nitro-3-pyrazole-carboxylic acid Methyl ester
    • 5-Nitro-1H-pyrazol-3-carboxylic acid methyl ester
    • 1H-Pyrazole-3-carboxylic acid, 5-nitro-, methyl ester
    • OTINMTPELZSAPX-UHFFFAOYSA-N
    • ZERO/008156
    • methylnitropyrazolecarboxylate
    • KSC537S2L
    • BCP22847
    • STK346689
    • EBD25456
    • AM9736
    • MB-0822
    • 181585-93-3
    • EU-0050446
    • J-522503
    • AKOS001681793
    • CS-0043772
    • SY081691
    • EN300-137796
    • 1H-Pyrazole-5-carboxylic acid, 3-nitro-, methyl ester
    • 1008112-06-8
    • BB 0259994
    • 2,5-DIMETHYLPHENETHYLALCOHOL
    • BCP9000918
    • DTXSID90361632
    • SCHEMBL25449
    • AKOS000311111
    • MFCD08236713
    • 1H-Pyrazole-3-carboxylicacid,5-nitro-,methyl ester
    • A880985
    • SCHEMBL17199593
    • FT-0702773
    • AB06278
    • DB-065368
    • BBL037969
    • DB-370837
    • MDL： MFCD08236713
    • Inchi： 1S/C5H5N3O4/c1-12-5(9)3-2-4(7-6-3)8(10)11/h2H,1H3,(H,6,7)
    • InChI Key： OTINMTPELZSAPX-UHFFFAOYSA-N
    • SMILES： O(C)C(C1C=C([N+](=O)[O-])NN=1)=O

Computed Properties

  • Exact Mass: 171.02800
  • Monoisotopic Mass: 171.028
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 201
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 101
  • XLogP3: 0.6

Experimental Properties

  • Color/Form: No data available
  • Density: 1.545±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 145.5 oC
  • Boiling Point: 388.3°C at 760 mmHg
  • Flash Point: 188.7°C
  • Refractive Index: 1.584
  • Solubility: Slightly soluble (1.4 g/l) (25 o C),
  • PSA: 100.80000
  • LogP: 0.62770

Methyl 5-nitro-1H-pyrazole-3-carboxylate Security Information

Methyl 5-nitro-1H-pyrazole-3-carboxylate Customs Data

  • HS CODE：2933199090
  • Customs Data：

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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