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2-synephrine

2-synephrine structure

CAS No:
575-81-5
Formula:
C9H13NO2
Chemical Name:
2-synephrine
Synonyms:
2-hydroxy-alpha-((methylamino)methyl)benzenemethanol;2-synephrine;ortho-synephrine;2-[1-hydroxy-2-(methylamino)ethyl]phenol;SCHEMBL2670073;CTK1H0762;DTXSID30973036
Categories:
Organic Chemistry > Amides

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2-synephrine Basic Attributes

Molecular Weight：

167.20500

Exact Mass：

167.09500

Characteristics

PSA：

52.49000

XLogP3：

1.03590

Density：

1.159g/cm3

Boiling Point：

341.1ºC at 760mmHg

Flash Point：

163.4ºC

Drug Information

MeSH Entry Terms：

2-hydroxy-alpha-((methylamino)methyl)benzenemethanol

Computed Properties

Molecular Weight:167.20
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:167.094628657
Monoisotopic Mass:167.094628657
Topological Polar Surface Area:52.5
Heavy Atom Count:12
Complexity:130
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes