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Home > Encyclopedia > 2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine

2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine

2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine structure

2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine 

structure
  • CAS No:

    113251-10-8

  • Formula:

    C12H12ClN3O3

  • Chemical Name:

    2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine

  • Synonyms:

    4-Chloro-3-ethoxy-7-guanidinoisocoumarin; Guanidine,N-(4-chloro-3-ethoxy-1-oxo-1H-2-benzopyran-7-yl); CEGIC;

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

2-(4-chloro-3-ethoxy-1-oxoisochromen-7-yl)guanidine Basic Attributes

281.69500

281.0567189 g/mol

DTXSID40150331

Characteristics

101.34000

3.02350

1.51g/cm3

549.4ºC

286.1ºC

1.648

4.04E-12mmHg at 25°C

Drug Information

4-chloro-3-ethoxy-7-guanidinoisocoumarin

Computed Properties

Molecular Weight:281.69
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:281.0567189
Monoisotopic Mass:281.0567189
Topological Polar Surface Area:99.9
Heavy Atom Count:19
Complexity:432
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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