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3-(1-Isoquinolinyl)Propanoic Acid
[CAS# 344334-31-2]

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Identification
Name 3-(1-Isoquinolinyl)Propanoic Acid
Molecular Structure CAS#: 344334-31-2, 3-(1-Isoquinolinyl)Propanoic Acid
Molecular Formula C12H11NO2
Molecular Weight 201.22
CAS Registry Number 344334-31-2
SMILES c1ccc2c(c1)ccnc2CCC(=O)O
InChI 1S/C12H11NO2/c14-12(15)6-5-11-10-4-2-1-3-9(10)7-8-13-11/h1-4,7-8H,5-6H2,(H,14,15)
InChIKey MZBGKUUUMZHXCL-UHFFFAOYSA-N
Properties
Density 1.252g/cm3 (Cal.)
Boiling point 396.146°C at 760 mmHg (Cal.)
Flash point 193.382°C (Cal.)
Refractive index 1.64 (Cal.)
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