Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

Modify Date: 2025-08-22 21:02:12

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate structure	Common Name	Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate
	CAS Number	139481-44-0	Molecular Weight	411.453
	Density	1.2±0.1 g/cm3	Boiling Point	630.4±65.0 °C at 760 mmHg
	Molecular Formula	C₂₅H₂₁N₃O₃	Melting Point	168 °C
	MSDS	N/A	Flash Point	335.1±34.3 °C

Name	Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate
Synonym	More Synonyms

Density	1.2±0.1 g/cm3
Boiling Point	630.4±65.0 °C at 760 mmHg
Melting Point	168 °C
Molecular Formula	C₂₅H₂₁N₃O₃
Molecular Weight	411.453
Flash Point	335.1±34.3 °C
Exact Mass	411.158295
PSA	77.14000
LogP	5.45
Vapour Pressure	0.0±1.8 mmHg at 25°C
Index of Refraction	1.619
InChIKey	KSXLHOFDCDKQLH-UHFFFAOYSA-N
SMILES	CCOc1nc2cccc(C(=O)OC)c2n1Cc1ccc(-c2ccccc2C#N)cc1

Hazard Codes	Xi
HS Code	2933990090

Tetraethyl orthocarbonate structure

Tetraethyl orth...

CAS#:78-09-1

Methyl 3-amino-2-[[(2'-cyanobiphenyl-4-yl)methyl]amino]benzoate structure

Methyl 3-amino-...

CAS#:136304-78-4

~93%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Kubo, Keiji; Kohara, Yasuhisa; Imamiya, Eiko; Sugiura, Yoshihiro; Inada, Yoshiyuki; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 15 p. 2182 - 2195

Methyl-2-ethoxybenzimidazole-7-carboxylate structure

Methyl-2-ethoxy...

CAS#:150058-27-8

4-Bromomethyl-2-cyanobiphenyl structure

4-Bromomethyl-2...

CAS#:114772-54-2

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: WO2006/15134 A1, ; Page/Page column 16; 21-22 ;

1-Methyl-3-nitrophthalate structure

1-Methyl-3-nitr...

CAS#:21606-04-2

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

acid chloride of 1-methylhydrogen-3-nitrophthalate structure

acid chloride o...

CAS#:73833-13-3

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

3-Nitrophthalic acid structure

3-Nitrophthalic acid

CAS#:603-11-2

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

Methyl 2-(tert-Butoxycarbonylamino)-3-nitrobenzoate structure

Methyl 2-(tert-...

CAS#:57113-90-3

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

methyl 2-(azidocarbonyl)-3-nitrobenzoate structure

methyl 2-(azido...

CAS#:856414-36-3

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-nitrobenzoate structure

methyl 2-[[4-(2...

CAS#:139481-38-2

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

Methyl 2-(((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)amino)-3-nitrobenzoate structure

Methyl 2-(((2'-...

CAS#:139481-28-0

~%

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Structure

Methyl 1-((2'-c...

CAS#:139481-44-0

Literature: Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

Precursor 10
CAS#:78-09-1 Tetraethyl orth... CAS#:136304-78-4 Methyl 3-amino-... CAS#:150058-27-8 Methyl-2-ethoxy... CAS#:114772-54-2 4-Bromomethyl-2...
CAS#:21606-04-2 1-Methyl-3-nitr... CAS#:73833-13-3 acid chloride o... CAS#:603-11-2 3-Nitrophthalic acid CAS#:57113-90-3 Methyl 2-(tert-...
CAS#:856414-36-3 methyl 2-(azido... CAS#:139481-38-2 methyl 2-[[4-(2...
DownStream 7
CAS#:863031-21-4 Azilsartan medoxomil CAS#:139481-59-7 Candesartan CAS#:139481-69-9 Candesartan Met... CAS#:147403-03-0 Azilsartan
CAS#:147403-52-9 1-[[2'-(2,5-Dih... CAS#:147403-65-4 2-Ethoxy-1-[[2'... CAS#:139481-33-7 methyl 1-[(2'-c...

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Methyl 1-[(2'-cyanobiphenyl-4-yl)methyl]-2-ethoxy-1H-benzimidazole-7-carboxylate

T56 BN DNJ B1R DR BCN&& CO2 IVO1

methyl 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-ethoxybenzimidazole-4-carboxylate

Methyl 1-[(2'-cyano-4-biphenylyl)methyl]-2-ethoxy-1H-benzimidazole-7-carboxylate

1H-Benzimidazole-7-carboxylic acid, 1-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-2-ethoxy-, methyl ester

1H-benzimidazole-7-carboxylicacid,1-[(2-cyano-[1,1’-biphenyl]-4-yl)methyl]-2-ethoxy-,methyl ester

METHYL 1-(2'-CYANOBIPHENYL-4-YL)METHYL-2-ETHOXY BENZIMIDAZOLE-7-CARBOXYLATE(EBC-II)

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