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Home > Encyclopedia > 3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine

3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine

3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine structure

3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine 

structure
  • CAS No:

    202197-26-0

  • Formula:

    C13H11ClFNO

  • Chemical Name:

    3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine

  • Synonyms:

    Benzenamine,3-chloro-4-[(3-fluorophenyl)methoxy]-;3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine;3-Chloro-4-[(3-fluorobenzyl)oxy]aniline;[3-Chloro-4-(3-fluorobenzyloxy)phenyl]amine;4-(3-Fluorobenzyloxy)-3-chloroaniline;3-Chloro-4-[(3-fluorophenyl)methoxy]aniline

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Tan Solid

3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine Basic Attributes

251.684

251.68

445-590-4

DTXSID10427603

2922299090

Characteristics

35.25000

3.4

1.3±0.1 g/cm3

78.0 to 82.0 °C

387.9±32.0 °C at 760 mmHg

188.4±25.1 °C

1.607

3.19E-06mmHg at 25°C

Safety Information

III

3077

P201, P202, P260, P264, P270, P273, P281, P301+P312, P308+P313, P314, P330, P391, P405, P501

H302

|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P260, P264, P270, P273, P281, P301+P312, P308+P313, P314, P330, P391, P405, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 4 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H302 (98.9%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 91 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3-Chloro-4-[(3-fluorophenyl)methoxy]benzenamine Use and Manufacturing

3-Chloro-4-(3-fluorobenzyloxy)aniline is an intermediate in the synthesis of Lapatinib (L175800).

Computed Properties

Molecular Weight:251.68
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:251.0513198
Monoisotopic Mass:251.0513198
Topological Polar Surface Area:35.2
Heavy Atom Count:17
Complexity:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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