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CS-W001157 4
Total: USD 88.00

2-[(benzenesulfonyl)methyl]aniline

  • CAS No. 95539-67-6

  • Cat. No. CS-0259248
  • Molecule weight247.31
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2-[(benzenesulfonyl)methyl]aniline|CS-0259248

Structure of 95539-67-6

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General Information

  • CAS No. 95539-67-6
  • Cat. No. CS-0259248
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO₂S
  • Molecular Weight 247.31
  • Synonym(s) 2-(benzenesulfonylmethyl)aniline
  • SMILES NC1=CC=CC=C1CS(=O)(C2=CC=CC=C2)=O

Synthesis

  • Route1
    • null|null
      69709-34-8
    • ~92%
    • 2-[(benzenesulfonyl)methyl]aniline|CS-0259248
      95539-67-6

    References

    • Babu, Govindarajulu; Orita, Akihiro; Otera, Junzo Organic Letters, 2005 , vol. 7, # 21 p. 4641 - 4643
  • Route2
    • null|null
      612-23-7
    • ~%
    • 2-[(benzenesulfonyl)methyl]aniline|CS-0259248
      95539-67-6

    References

    • Babu, Govindarajulu; Orita, Akihiro; Otera, Junzo Organic Letters, 2005 , vol. 7, # 21 p. 4641 - 4643
  • Route3

    References

    • Babu, Govindarajulu; Orita, Akihiro; Otera, Junzo Organic Letters, 2005 , vol. 7, # 21 p. 4641 - 4643

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.16
  • LogP   2.2427
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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