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4-(3,4-Dihydro-2(1H)-Isoquinolinylmethyl)Benzoic Acid
[CAS# 333357-96-3]

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Identification
Name 4-(3,4-Dihydro-2(1H)-Isoquinolinylmethyl)Benzoic Acid
Synonyms 4-(1,2,3,4-tetrahydroisoquinolin-2-; ylmethyl)benzoic acid; 4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-benzoic acid; 4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)benzoic acid
Molecular Structure CAS#: 333357-96-3, 4-(3,4-Dihydro-2(1H)-Isoquinolinylmethyl)Benzoic Acid
Molecular Formula C17H17NO2
Molecular Weight 267.32
CAS Registry Number 333357-96-3
SMILES O=C(O)c1ccc(cc1)CN3Cc2c(cccc2)CC3
InChI 1S/C17H17NO2/c19-17(20)15-7-5-13(6-8-15)11-18-10-9-14-3-1-2-4-16(14)12-18/h1-8H,9-12H2,(H,19,20)
InChIKey YGDCSVTTWQYOCN-UHFFFAOYSA-N
Properties
Density 1.225g/cm3 (Cal.)
Boiling point 435.475°C at 760 mmHg (Cal.)
Flash point 217.167°C (Cal.)
Refractive index 1.635 (Cal.)
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