4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic acid | CAS No. 181696-35-5

Basic Information

4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic acid

CAS Number

181696-35-5

Molecular Formula

C16H13NO4S

Molecular Weight

315.35 g/mol

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Basic Physical Properties

SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C16H13NO4S/c1-11-15(12-7-9-14(10-8-12)22(18,19)20)16(17-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H,18,19,20)

InChIKey

LLWOSCPRJRUVST-UHFFFAOYSA-N

LogP

3.5637200000000018

Topological Polar Surface Area

80.4 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

461

Classification & Uses

Safety Information

View Safety Information

Hazard Statement

H302-H315-H319-H335

Synonyms & References

English

  • 4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic acid
  • 2,6-DICHLORO-4-(TRIFLUOROMETHYLOXY)BROMOBEN
  • VALDECOXIB IMPURITY D
  • Valdecoxib Sulfonic
  • Valdecoxib Sulfonic Acid
  • 4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonic acid
  • 2,6-DICHLORO-4-(TRIFLUOROMETHYLOXY)BROMOBENZENE
  • Valdecoxib IMpurity-D (Valdecoxib SulfonicAcid)
  • 4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulfonic Acid
  • Benzenesulfonic acid, 4-(5-Methyl-3-phenyl-4-isoxazolyl)-
  • 3-Phenyl-4-(4-aMinosulfonylbenzyl)-5-Methylisoxazole ,Valdecoxib Sulfonyl Chloride ,valdecoxib iMpurity D
  • AK133366
  • BCP23915
  • BC600175
  • AX8254917
  • 4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)b
  • 4-(5-Methyl-3-phenylisoxazol-4-yl)phenylsulfonic acid
  • J-011615
  • Y69WDQ5EHC
  • UNII-Y69WDQ5EHC
  • Valdecoxib metabolite M8
  • MFCD26743607
  • Benzenesulfonic acid, 4-(5-methyl-3-phenyl-4-isoxazolyl)-
  • 4-(5-Methyl-3-phenylisoxazol-4-yl)phenylsulphonic acid
  • C73495
  • 4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonicacid
  • Parecoxib Impurity 8; Valdecoxib Sulfonic Acid; 4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulfonic Acid
  • 4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonic Acid
  • 4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)benzene-1-sulfonic acid
  • AKOS016844932
  • SCHEMBL6013897
  • A880978
  • Benzenesulphonic acid, 4-(5-methyl-3-phenyl-4-isoxazolyl)-
  • ValdecoxibSulfonicAcid-13C2,15N
  • DTXSID60468703
  • Valdecoxib Impurity D
  • DS-4699
  • 4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulphonic acid
  • CS-W007260
  • 181696-35-5

MDL_Number

MFCD31543896

CAS Number

181696-35-5

Customs_Code

2934999090

Supplier Information

Supplier Name Member Level Authentication Status Main Category MOQ Action
ChinaChina - Shanghai Zherui Biotechnology Co., Ltd.
ChinaChina - Shandong Fande Medicine Technology Co., Ltd.
ChinaChina - Hubei Hongxin Chemical Reagents Co., Ltd.
ChinaChina - Hubei De Ao Hua Yan Yiyao Technology Co., Ltd.
ChinaChina - Shanghai Kewei Chemical Technology Co., Ltd.
ChinaChina - Shenzhen Xingyue Biotechnology Co., Ltd.
ChinaChina - Jin Jinle (Hunan) Chemical Co., Ltd.
ChinaChina - Shanghai Aladdin Bio-Technologies Co., Ltd.

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