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Structure

6,7-Isoquinolinediol,1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-2-methyl-,(1S)-

CAS
57231-31-9
Catalog Number
ACM57231319
Category
Other Products
Molecular Weight
301.33706
Molecular Formula
C17H19NO4

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Specification

Synonyms
(S)-1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-2-methylisoquinoline-6,7-diol;(1S)-1α-(3,4-Dihydroxybenzyl)-2-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol;(1S)-1α-[(3,4-Dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-2-methyl-6,7-isoquinolinediol;Ein
IUPAC Name
1-[(3,4-dihydroxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol
Canonical SMILES
CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)O)O)O)O
InChI Key
VHRSWCTVFBWHKE-UHFFFAOYSA-N
Boiling Point
548ºC at 760mmHg
Flash Point
323ºC
Density
1.373g/cm³
EC Number
260-635-6
Exact Mass
301.13100
H-Bond Acceptor
5
H-Bond Donor
4
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