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Home > Encyclopedia > 3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid

3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid

3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid structure

3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid 

structure
  • CAS No:

    765269-29-2

  • Formula:

    C13H17BrN2O2

  • Chemical Name:

    3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid

  • Synonyms:

    3-bromo-4-((4-methylpiperazin-1-yl)methyl)benzoic acid;3-bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid;SCHEMBL13529185;CTK5E3065;DTXSID70630272;SBB067872;ZINC33414771;AKOS015851020;DB-002037;FT-0656746

3-Bromo-4-[(4-methylpiperazin-1-yl)methyl]benzoic acid Basic Attributes

313.195

312.04700

DTXSID70630272

2933599090

Characteristics

43.8

1.77050

1.452g/cm3

420.6ºC at 760 mmHg

208.2ºC

1.603

Safety Information

Xi

Computed Properties

Molecular Weight:313.19
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:312.04734
Monoisotopic Mass:312.04734
Topological Polar Surface Area:43.8
Heavy Atom Count:18
Complexity:293
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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