3-(Methylthio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Name: 3-(Methylthio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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CAS No. 607697-02-9
Cat. No. CS-0331639
Molecule weight348.39
Purity≥97%
MDL No.MFCD03102538

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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3-(Methylthio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile|CS-0331639

Structure of 607697-02-9

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General Information

CAS No. 607697-02-9
Cat. No. CS-0331639
Purity ≥97%
MDL No. MFCD03102538
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₈H₁₅F₃N₂S
Molecular Weight 348.39
Synonym(s) 3-(METHYLSULFANYL)-1-[3-(TRIFLUOROMETHYL)PHENYL]-5,6,7,8-TETRAHYDRO-4-ISOQUINOLINECARBONITRILE
SMILES CSC1=NC(=C2CCCCC2=C1C#N)C3=CC(=CC=C3)C(F)(F)F

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 36.68
LogP 5.23978
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-(Methylthio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

CAS No. 607697-02-9

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