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1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester

1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester Structure
CAS No.
3543-72-4
Chemical Name:
1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester
Synonyms
Ibanic acid;Bendamustine Impurity 30;Bendamustine Nitro Ethyl Ester;Bendamustine Related Impurity 18;Bendamustine ethyl ester impurity;BendaMustine Nitro Ethyl Ester IMpurity;2,2'-bipyridine, 5-(2,5-dimethyl-1h-pyrrol-1-yl)-;Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl);ethyl 4-(1-methyl-5-nitrobenzimidazol-2-yl)butanoate;4-(1-Methyl-5-Nitro-1H-Benzo[D]Imidazol-2-Yl)Butanoate
CBNumber:
CB62485214
Molecular Formula:
C14H17N3O4
Molecular Weight:
291.3
MOL File:
3543-72-4.mol
MSDS File:
SDS
Modify Date:
2025/3/14 16:02:10

1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester Properties

Melting point 100-104°C
Boiling point 481.0±25.0 °C(Predicted)
Density 1.30±0.1 g/cm3(Predicted)
storage temp. 2-8°C
solubility Dichloromethane, Ethyl Acetate, Methanol
form Solid
pka 3.78±0.10(Predicted)
color Brown
InChI InChI=1S/C14H17N3O4/c1-3-21-14(18)6-4-5-13-15-11-9-10(17(19)20)7-8-12(11)16(13)2/h7-9H,3-6H2,1-2H3
InChIKey VJVBGSJZBDBEIF-UHFFFAOYSA-N
SMILES C1(CCCC(OCC)=O)N(C)C2=CC=C([N+]([O-])=O)C=C2N=1

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H332-H302-H312
Precautionary statements  P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501

1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester Chemical Properties,Uses,Production

Chemical Properties

Light Brown Solid

Uses

Labelled Bendamustine

Uses

1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester is a Bendamustine intermediate.

1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester Preparation Products And Raw materials

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ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate 1-Methyl-5-nitro-1H-benzimidazole-2-butanoic acid ethyl ester (5-Nitro-1-Methyl-1H-benzo[d]iMidazol-2-yl)butanoic acid ethyl ester ethyl 4-(1-Methyl-5-nitro-1H-1,3-benzodiazol-2-yl)butanoate 1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester-d3 BendaMustine Nitro Ethyl Ester IMpurity Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl) ethyl 4-(1-methyl-5-nitrobenzimidazol-2-yl)butanoate Bendamustine Related Impurity 18 2,2'-bipyridine, 5-(2,5-dimethyl-1h-pyrrol-1-yl)- Bendamustine impurity (1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester) 4-(1-methyl-5-nitro-2-benzimidazolyl)butanoic acid ethyl ester 4-(1-Methyl-5-Nitro-1H-Benzo[D]Imidazol-2-Yl)Butanoate Bendamustine Impurity 30 1H-Benzimidazole-2-butanoic acid, 1-methyl-5-nitro-, ethyl ester 1H-BENZIMIDAZOLE-2-BUTANOIC ACID 1-METHY L-5-NITRO ETHYL ESTER DAM3P ETHYL 4-(1-METHYL-5-NITRO-1HBENZIMIDAZOL-2-YL) BUTANOATE Bendamustine ethyl ester impurity TIANFU-CHEM - ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate Bendamustine Nitro Ethyl Ester Ethyl 4-(1-Methyl-5-nitro-1H-benzoimidazol-2-yl)-butyrate Ibanic acid 3543-72-4 C14N14D3N3O4 Heterocycles Intermediates Intermediates & Fine Chemicals Isotope Labelled Compounds Pharmaceuticals Aromatics