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Structure

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

CAS
130465-39-3
Catalog Number
ACM130465393
Category
Other Products
Molecular Weight
307.77
Molecular Formula
C16H17NO3.ClH
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Specification

Synonyms
A-68930 hydrochloride, 130465-39-3, cis-1-(Aminomethyl)-3-phenylisochroman-5,6-diol hydrochloride, SureCN1877853, CTK8B6842, MolPort-003-983-502, ANW-54582, CCG-222538, LP01234, KB-251193, cis-( inverted exclamation markA)-1-(Aminomethyl)-3,4-dihydro-3-phenyl-1H-2-benzopyran-5,6-diol hydrochloride, CIS-(+/-)-1-(AMINOMETHYL)-3,4-DIHYDRO-3-PHENYL-1H-2-BENZOPYRAN-5,6-DIOL HYDROCHLORIDE
IUPAC Name
(1R,3S)-1-(aminomethyl)-3-phenyl-3,4-dihydro-1H-isochromene-5,6-diol;hydrochloride
Canonical SMILES
C1C(OC(C2=C1C(=C(C=C2)O)O)CN)C3=CC=CC=C3.Cl
InChI Key
PQPGUUQPTSMLKU-YYLIZZNMSA-N
Melting Point
250ºC
Appearance
off-white Solid
Exact Mass
307.09800
H-Bond Acceptor
4
H-Bond Donor
4
Safety Description
22-24/25
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