Cas no 865138-11-0 (5-tert-butyl-1H-pyrazole-3-carbaldehyde)

5-tert-butyl-1H-pyrazole-3-carbaldehyde structure
865138-11-0 structure
Product Name:5-tert-butyl-1H-pyrazole-3-carbaldehyde
CAS No:865138-11-0
MF:C8H12N2O
MW:152.193681716919
MDL:MFCD09864384
CID:1087066
PubChem ID:23157265
Update Time:2025-04-20

5-tert-butyl-1H-pyrazole-3-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-(tert-Butyl)-1H-pyrazole-3-carbaldehyde
    • 3-tert-Butyl-1H-pyrazole-5-carbaldehyde
    • 5-tert-Butyl-1H-pyrazole-3-carbaldehyde
    • 5-tert-butyl-1H-pyrazole-3-carbaldehyde(SALTDATA: FREE)
    • 3-(tert-butyl)-1H-pyrazole-5-carbaldehyde
    • SB75072
    • 865138-11-0
    • SCHEMBL2827757
    • FT-0755784
    • MFCD09864384
    • DTXSID70631082
    • AKOS022185056
    • LS-03435
    • UPKIRZZYJRVBSJ-UHFFFAOYSA-N
    • SCHEMBL24323593
    • Z1198235246
    • F2167-1312
    • 5-tert-Butyl-1H-pyrazole-3-carbaldehyde, AldrichCPR
    • AT15965
    • AKOS000111482
    • EN300-239851
    • 5-tert-butyl-2H-pyrazole-3-carbaldehyde
    • ALBB-010103
    • 1276030-62-6
    • STK506209
    • DA-18693
    • 1H-pyrazole-5-carboxaldehyde, 3-(1,1-dimethylethyl)-
    • 5-tert-butyl-1H-pyrazole-3-carbaldehyde
    • MDL: MFCD09864384
    • Inchi: 1S/C8H12N2O/c1-8(2,3)7-4-6(5-11)9-10-7/h4-5H,1-3H3,(H,9,10)
    • InChI Key: UPKIRZZYJRVBSJ-UHFFFAOYSA-N
    • SMILES: O=CC1C=C(C(C)(C)C)NN=1

Computed Properties

  • Exact Mass: 152.09500
  • Monoisotopic Mass: 152.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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
  • XLogP3: 1.7
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • Boiling Point: 285.2±20.0°C at 760 mmHg
  • PSA: 45.75000
  • LogP: 1.51970

5-tert-butyl-1H-pyrazole-3-carbaldehyde Security Information

  • Hazard Statement: H302-H315-H319-H335
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

5-tert-butyl-1H-pyrazole-3-carbaldehyde 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%

5-tert-butyl-1H-pyrazole-3-carbaldehyde Pricemore >>

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