2-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]acetic acid

Modify Date: 2025-08-26 08:52:58

2-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]acetic acid structure	Common Name	2-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]acetic acid
	CAS Number	114772-03-1	Molecular Weight	351.78500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₆H₁₈ClN₃O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	2-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]acetic acid

Molecular Formula	C₁₆H₁₈ClN₃O₄
Molecular Weight	351.78500
Exact Mass	351.09900
PSA	100.94000
LogP	3.98590
InChIKey	GSXCMKWZZYPXIJ-UHFFFAOYSA-N
SMILES	CCCCc1nc(Cl)c(CC(=O)O)n1Cc1ccc([N+](=O)[O-])cc1

2-Butyl-4-chlor...

CAS#:114771-99-2

~97%

2-[2-butyl-5-ch...

CAS#:114772-03-1

Literature: Duncia, John V.; Chiu, Andrew T.; Carini, David J.; Gregory, George B.; Johnson, Alexander L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 5 p. 1312 - 1329

2-Butyl-4-chlor...

CAS#:114799-92-7

2-[2-butyl-5-ch...

CAS#:114772-03-1

Literature: Duncia, John V.; Chiu, Andrew T.; Carini, David J.; Gregory, George B.; Johnson, Alexander L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 5 p. 1312 - 1329

(2-Butyl-5-chlo...

CAS#:79047-41-9

2-[2-butyl-5-ch...

CAS#:114772-03-1

Literature: Duncia, John V.; Chiu, Andrew T.; Carini, David J.; Gregory, George B.; Johnson, Alexander L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 5 p. 1312 - 1329

4-nitrobenzylbromide

CAS#:100-11-8

2-[2-butyl-5-ch...

CAS#:114772-03-1

Literature: Duncia, John V.; Chiu, Andrew T.; Carini, David J.; Gregory, George B.; Johnson, Alexander L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 5 p. 1312 - 1329

N/A

CAS#:125665-56-7

2-[2-butyl-5-ch...

CAS#:114772-03-1

Literature: Duncia, John V.; Chiu, Andrew T.; Carini, David J.; Gregory, George B.; Johnson, Alexander L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 5 p. 1312 - 1329

Precursor 4
CAS#:114771-99-2 2-Butyl-4-chlor... CAS#:114799-92-7 2-Butyl-4-chlor... CAS#:79047-41-9 (2-Butyl-5-chlo... CAS#:100-11-8 4-nitrobenzylbromide
DownStream 0

Names