2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid

Modify Date: 2025-08-24 10:23:47

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure
2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid structure
 Common Name 2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid
CAS Number 16390-26-4 Molecular Weight 327.76200
Density N/A Boiling Point N/A
Molecular Formula C18H14ClNO3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C18H14ClNO3
Molecular Weight 327.76200
Exact Mass 327.06600
PSA 59.30000
LogP 3.91870
InChIKey QDAPWMKWLVMBBU-UHFFFAOYSA-N
SMILES Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(Cl)cc1

 Synthetic Route

N/A structure

N/A

CAS#:53472-24-5

~76%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Arisawa, Mitsuhiro; Kasaya, Yayoi; Obata, Tohru; Sasaki, Takuma; Nakamura, Tomonori; Araki, Takuya; Yamamoto, Koujirou; Sasaki, Akito; Yamano, Akihito; Ito, Mika; Abe, Hiroshi; Ito, Yoshihiro; Shuto, Satoshi Journal of Medicinal Chemistry, 2012 , vol. 55, # 18 p. 8152 - 8163
(2-Methyl-1H-indol-3-yl)acetic acid structure

(2-Methyl-1H-in...

CAS#:1912-43-2

4-Chlorobenzoyl chloride structure

4-Chlorobenzoyl...

CAS#:122-01-0

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: DOMPE' S.P.A. Patent: WO2004/69782 A2, 2004 ; Location in patent: Page 27; 28 ; WO 2004/069782 A2
Phenylhydrazine structure

Phenylhydrazine

CAS#:100-63-0

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Maguire, Anita R.; Plunkett, Stephen J.; Papot, Sebastien; Clynes, Martin; O'Connor, Robert; Touhey, Samantha Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 3 p. 745 - 762
acetaldehyde phenylhydrazone structure

acetaldehyde ph...

CAS#:935-07-9

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Maguire, Anita R.; Plunkett, Stephen J.; Papot, Sebastien; Clynes, Martin; O'Connor, Robert; Touhey, Samantha Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 3 p. 745 - 762
acetaldehyde N1-(4-chlorobenzoyl)-N1-phenylhydrazone structure

acetaldehyde N1...

CAS#:345960-80-7

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Maguire, Anita R.; Plunkett, Stephen J.; Papot, Sebastien; Clynes, Martin; O'Connor, Robert; Touhey, Samantha Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 3 p. 745 - 762
benzyl 2-(2-methyl-1H-indol-3-yl)acetate structure

benzyl 2-(2-met...

CAS#:502607-41-2

4-Chlorobenzoyl chloride structure

4-Chlorobenzoyl...

CAS#:122-01-0

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Arisawa, Mitsuhiro; Kasaya, Yayoi; Obata, Tohru; Sasaki, Takuma; Ito, Mika; Abe, Hiroshi; Ito, Yoshihiro; Yamano, Akihito; Shuto, Satoshi ACS Medicinal Chemistry Letters, 2011 , vol. 2, # 5 p. 353 - 357
Levulinic acid structure

Levulinic acid

CAS#:123-76-2

N1-(4-chlorobenzoyl)-N1-phenylhydrazine hydrochloride structure

N1-(4-chloroben...

CAS#:55130-75-1

~27%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Maguire, Anita R.; Plunkett, Stephen J.; Papot, Sebastien; Clynes, Martin; O'Connor, Robert; Touhey, Samantha Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 3 p. 745 - 762
benzyl 2-(2-methyl-1H-indol-3-yl)acetate structure

benzyl 2-(2-met...

CAS#:502607-41-2

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Arisawa, Mitsuhiro; Kasaya, Yayoi; Obata, Tohru; Sasaki, Takuma; Nakamura, Tomonori; Araki, Takuya; Yamamoto, Koujirou; Sasaki, Akito; Yamano, Akihito; Ito, Mika; Abe, Hiroshi; Ito, Yoshihiro; Shuto, Satoshi Journal of Medicinal Chemistry, 2012 , vol. 55, # 18 p. 8152 - 8163
2-Methylindole structure

2-Methylindole

CAS#:95-20-5

~%

2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid Structure

2-[1-(4-chlorob...

CAS#:16390-26-4

Literature: Arisawa, Mitsuhiro; Kasaya, Yayoi; Obata, Tohru; Sasaki, Takuma; Nakamura, Tomonori; Araki, Takuya; Yamamoto, Koujirou; Sasaki, Akito; Yamano, Akihito; Ito, Mika; Abe, Hiroshi; Ito, Yoshihiro; Shuto, Satoshi Journal of Medicinal Chemistry, 2012 , vol. 55, # 18 p. 8152 - 8163

 Synonyms

1-(4-chlorobenzoyl)-2-methylindole-3-acetic acid
1H-Indole-3-acetic acid,1-(4-chlorobenzoyl)-2-methyl
[1-(4-chloro-benzoyl)-2-methyl-indol-3-yl]-acetic acid
[1-(4-chlorobenzoyl)-2-methyl-1H-indol-3-yl]acetic acid
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Chemsrc provides CAS#:16390-26-4 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid>> amp version: 2-[1-(4-chlorobenzoyl)-2-methylindol-3-yl]acetic acid

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