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2-(3H-benzimidazol-1-ium-1-yl)ethyl-(3-methylbutyl)azanium;oxalate

2-(3H-benzimidazol-1-ium-1-yl)ethyl-(3-methylbutyl)azanium;oxalate structure

CAS No:
31488-80-9
Formula:
C16H23N3O4
Chemical Name:
2-(3H-benzimidazol-1-ium-1-yl)ethyl-(3-methylbutyl)azanium;oxalate
Synonyms:
BENZIMIDAZOLE-3-ETHYLAMINE, N-ISOPENTYL-, SESQUIOXALATE;31488-80-9;N-Isopentyl-benzimidazole-3-ethylamine sesquioxalate;DTXSID00185386

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2-(3H-benzimidazol-1-ium-1-yl)ethyl-(3-methylbutyl)azanium;oxalate Basic Attributes

Molecular Weight：

321.37 g/mol

Exact Mass：

321.16885622 g/mol

DSSTox ID：

DTXSID00185386

Characteristics

PSA：

117 Å²

Computed Properties

Molecular Weight:321.37
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:321.16885622
Monoisotopic Mass:321.16885622
Topological Polar Surface Area:117
Heavy Atom Count:23
Complexity:278
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-(3H-benzimidazol-1-ium-1-yl)ethyl-(3-methylbutyl)azanium;oxalate

Basic Attributes
Characteristics
Computed Properties

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