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3-[(Hexahydro-1H-Azepin-1-Yl)Sulfonyl]-Benzenamine
[CAS# 91619-39-5]

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Identification
Name 3-[(Hexahydro-1H-Azepin-1-Yl)Sulfonyl]-Benzenamine
Synonyms 3-(1-Azepanylsulfonyl)Aniline; [3-(Azepan-1-Ylsulfonyl)Phenyl]Amine; Zinc03885461
Molecular Structure CAS#: 91619-39-5, 3-[(Hexahydro-1H-Azepin-1-Yl)Sulfonyl]-Benzenamine
Molecular Formula C12H18N2O2S
Molecular Weight 254.35
CAS Registry Number 91619-39-5
SMILES C2=C([S](=O)(=O)N1CCCCCC1)C=CC=C2N
InChI 1S/C12H18N2O2S/c13-11-6-5-7-12(10-11)17(15,16)14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9,13H2
InChIKey OXDMSVNDLGEMFK-UHFFFAOYSA-N
Properties
Density 1.242g/cm3 (Cal.)
Boiling point 443.77°C at 760 mmHg (Cal.)
Flash point 222.185°C (Cal.)
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