2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid

Modify Date: 2025-09-26 16:31:56

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure
2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid structure
 Common Name 2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid
CAS Number 54785-41-0 Molecular Weight 345.37000
Density 1.374g/cm3 Boiling Point 555.1ºC at 760 mmHg
Molecular Formula C17H15NO5S Melting Point N/A
MSDS N/A Flash Point 289.5ºC

 Names

Name 2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.374g/cm3
Boiling Point 555.1ºC at 760 mmHg
Molecular Formula C17H15NO5S
Molecular Weight 345.37000
Flash Point 289.5ºC
Exact Mass 345.06700
PSA 105.85000
LogP 4.16720
Index of Refraction 1.619
InChIKey XHVPXKQOWIHLEO-UHFFFAOYSA-N
SMILES CC(C(=O)O)c1ccc2oc(-c3ccc(S(C)(=O)=O)cc3)nc2c1

 Safety Information

HS Code 2934999090

 Synthetic Route

2-(4-hydroxyphenyl)propiononitrile structure

2-(4-hydroxyphe...

CAS#:21850-61-3

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2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
2-(4-hydroxy-3-nitrophenyl)butyronitrile structure

2-(4-hydroxy-3-...

CAS#:51234-22-1

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
Benzeneacetonitrile,3-amino-4-hydroxy--alpha--methyl- structure

Benzeneacetonit...

CAS#:51234-23-2

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
2-(4-aminophenyl)propanenitrile structure

2-(4-aminopheny...

CAS#:28694-90-8

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
N/A structure

N/A

CAS#:51234-67-4

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
3-amino-4-hydroxyphenyl-2-methylacetic acid structure

3-amino-4-hydro...

CAS#:51234-43-6

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
4-(Methanesulfonyl)benzoyl chloride structure

4-(Methanesulfo...

CAS#:40913-92-6

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
ethyl 2-(3-amino-4-hydroxyphenyl)-propionate structure

ethyl 2-(3-amin...

CAS#:51234-45-8

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58
3-amino-4-hydroxyphenyl-2-methylacetic acid structure

3-amino-4-hydro...

CAS#:51234-43-6

4-(Methanesulfonyl)benzoyl chloride structure

4-(Methanesulfo...

CAS#:40913-92-6

~%

2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid Structure

2-[2-(4-methyls...

CAS#:54785-41-0

Literature: Dunwell,D.W. et al. Journal of Medicinal Chemistry, 1975 , vol. 18, # 1 p. 53 - 58

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

2-[2-(4-methanesulfonyl-phenyl)-benzooxazol-5-yl]-propionic acid
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Chemsrc provides CAS#:54785-41-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid>> amp version: 2-[2-(4-methylsulfonylphenyl)-1,3-benzoxazol-5-yl]propanoic acid

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