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Home > Encyclopedia > Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI)

Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI)

Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI) structure

Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI) 

structure
  • CAS No:

    804427-92-7

  • Formula:

    C13H21NS

  • Chemical Name:

    Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI)

  • Synonyms:

    [3-methyl-4-(3-methylbutylsulfanyl)phenyl]methanamine;CTK5E7789;DTXSID40667631;A1-05261;1-{3-Methyl-4-[(3-methylbutyl)sulfanyl]phenyl}methanamine;BENZENEMETHANAMINE, 3-METHYL-4-[(3-METHYLBUTYL)THIO]-

Benzenemethanamine, 3-methyl-4-[(3-methylbutyl)thio]- (9CI) Basic Attributes

223.37754

223.139

DTXSID40667631

Characteristics

51.3

3.3

Computed Properties

Molecular Weight:223.38
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:223.13947085
Monoisotopic Mass:223.13947085
Topological Polar Surface Area:51.3
Heavy Atom Count:15
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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