Cas no 953039-66-2 (7-Bromo-2-chloroquinazoline)

7-Bromo-2-chloroquinazoline structure
7-Bromo-2-chloroquinazoline structure
Product Name:7-Bromo-2-chloroquinazoline
CAS No:953039-66-2
MF:C8H4BrClN2
MW:243.487759590149
MDL:MFCD11040175
CID:827233
PubChem ID:45790052
Update Time:2024-10-25

7-Bromo-2-chloroquinazoline Chemical and Physical Properties

Names and Identifiers

    • 7-Bromo-2-chloroquinazoline
    • PubChem14676
    • LEVIQMAFISIVMA-UHFFFAOYSA-N
    • BCP10060
    • PB10831
    • QUINAZOLINE, 7-BROMO-2-CHLORO-
    • SY023979
    • BC003905
    • ST1271493
    • AB0027844
    • W9736
    • 7-Bromo-2-chloroquinazoline (ACI)
    • MFCD11040175
    • 953039-66-2
    • AKOS015835909
    • CS-W009223
    • DTXSID50672195
    • AC-26955
    • SCHEMBL1633846
    • DS-10766
    • EN300-3259744
    • DB-080211
    • Z1269187846
    • 2-Chloro-7-bromoquinazoline
    • MDL: MFCD11040175
    • Inchi: 1S/C8H4BrClN2/c9-6-2-1-5-4-11-8(10)12-7(5)3-6/h1-4H
    • InChI Key: LEVIQMAFISIVMA-UHFFFAOYSA-N
    • SMILES: ClC1N=C2C(C=CC(=C2)Br)=CN=1

Computed Properties

  • Exact Mass: 241.92500
  • Monoisotopic Mass: 241.925
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 167
  • 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: 25.8
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3.2

Experimental Properties

  • Density: 1.762±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 240.2°C at 760 mmHg
  • Flash Point: 99.1°C
  • Refractive Index: 1.691
  • Solubility: Very slightly soluble (0.75 g/l) (25 o C),
  • PSA: 25.78000
  • LogP: 3.04570

7-Bromo-2-chloroquinazoline Security Information

7-Bromo-2-chloroquinazoline Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. 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:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

7-Bromo-2-chloroquinazoline Pricemore >>

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7-Bromo-2-chloroquinazoline Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Phosphorus oxychloride ;  3 h, 110 °C; 110 °C → rt
1.2 Solvents: Water ;  1 h, rt
Reference
Preparation of 6-6 bicyclic aromatic ring substituted nucleoside analogs for use as PRMT5 inhibitors
, World Intellectual Property Organization, , ,

Production Method 2

Reaction Conditions
1.1 Reagents: Phosphorus oxychloride Solvents: Phosphorus oxychloride ;  1 h, rt → 110 °C; 110 °C → rt
Reference
Preparation of quinazolines for PDK1 inhibition
, World Intellectual Property Organization, , ,

Production Method 3

Reaction Conditions
1.1 Reagents: Phosphorus oxychloride ;  110 °C
Reference
Novel Mps1 kinase inhibitors: From purine to pyrrolopyrimidine and quinazoline leads
Bursavich, Matthew G.; Dastrup, David; Shenderovich, Mark; Yager, Kraig M.; Cimbora, Daniel M.; et al, Bioorganic & Medicinal Chemistry Letters, 2013, 23(24), 6829-6833

Production Method 4

Reaction Conditions
Reference
Preparation of aminoquinazoline compounds as protein-kinase inhibitors
, World Intellectual Property Organization, , ,

7-Bromo-2-chloroquinazoline Raw materials

7-Bromo-2-chloroquinazoline Preparation Products

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