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Home > Encyclopedia > ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate

ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate

ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate structure

ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate 

structure
  • CAS No:

    3543-72-4

  • Formula:

    C14H17N3O4

  • Chemical Name:

    ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate

  • Synonyms:

    ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate;1-Methyl-5-nitro-1H-benzimidazole-2-butanoic acid ethyl ester;1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester-d3;(5-Nitro-1-Methyl-1H-benzo[d]iMidazol-2-yl)butanoic acid ethyl ester;BendaMustine Nitro Ethyl Ester IMpurity;ethyl 4-(1-Methyl-5-nitro-1H-1,3-benzodiazol-2-yl)butanoate;Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl);ethyl 4-(1-methyl-5-nitrobenzimidazol-2-yl)butanoate

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Light Brown Solid

ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate Basic Attributes

291.305

291.121918

1312995-182-4

DTXSID60517745

2933990090

Characteristics

89.9

2.73

1.3±0.1 g/cm3

100-104°C

481.0±25.0 °C at 760 mmHg

244.7±23.2 °C

1.599

Safety Information

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

H302

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate Use and Manufacturing

Labelled Bendamustine

Computed Properties

Molecular Weight:291.30
XLogP3:2.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:291.12190603
Monoisotopic Mass:291.12190603
Topological Polar Surface Area:89.9
Heavy Atom Count:21
Complexity:385
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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