1H-2-Benzopyran-5,6-diol, 1-(aminomethyl)-3,4-dihydro-3-phenyl-,hydrochloride, (1R,3S)-rel-


Chemical Name: 1H-2-Benzopyran-5,6-diol, 1-(aminomethyl)-3,4-dihydro-3-phenyl-,hydrochloride, (1R,3S)-rel-
CAS Number: 130465-39-3
Product Number: AG000UGA(AGN-PC-0PJ8HM)
Synonyms:
MDL No: MFCD05863727
Molecular Formula: C16H18ClNO3
Molecular Weight: 307.7720

Identification/Properties


Computed Properties
Molecular Weight:
307.774g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
307.098g/mol
Monoisotopic Mass:
307.098g/mol
Topological Polar Surface Area:
75.7A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
319
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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