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3-Amino-4-({2-[(Methylamino)Methyl]Phenyl}Sulfanyl)Benzonitrile
[CAS# 296774-10-2]

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Identification
Name 3-Amino-4-({2-[(Methylamino)Methyl]Phenyl}Sulfanyl)Benzonitrile
Synonyms MFCD08061459; 3-Amino-4-((2-((methylamino)methyl)phenyl)thio)benzonitrile
Molecular Structure CAS#: 296774-10-2, 3-Amino-4-({2-[(Methylamino)Methyl]Phenyl}Sulfanyl)Benzonitrile
Molecular Formula C15H15N3S
Molecular Weight 269.36
CAS Registry Number 296774-10-2
SMILES N#Cc2ccc(Sc1c(cccc1)CNC)c(c2)N
InChI 1S/C15H15N3S/c1-18-10-12-4-2-3-5-14(12)19-15-7-6-11(9-16)8-13(15)17/h2-8,18H,10,17H2,1H3
InChIKey ZIUUMKHZYUTZPC-UHFFFAOYSA-N
Properties
Density 1.239g/cm3 (Cal.)
Boiling point 437.489°C at 760 mmHg (Cal.)
Flash point 218.386°C (Cal.)
Refractive index 1.663 (Cal.)
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