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1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI)

1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI) structure

CAS No:
99459-47-9
Formula:
C9H8N2O2
Chemical Name:
1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI)
Synonyms:
1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI);6-Methyl-1H-1,3-benzodiazole-2-carboxylic acid;1H-benzimidazole-2-carboxylic acid, 6-methyl-;6-methyl-1H-benzimidazole-2-carboxylic acid;6-methyl-1H-benzimidazole-2-carboxylic acid(SALTDATA: FREE);5-methyl-1H-benzimidazole-2-carboxylic acid;5-methyl-1H-benzo[d]imidazole-2-carboxylic acid;5-methyl-1H-1,3-benzodiazole-2-carboxylic acid
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI) Basic Attributes

Molecular Weight：

176.17

Exact Mass：

176.058577502 g/mol

DSSTox ID：

DTXSID90363979

Characteristics

PSA：

65.98000

XLogP3：

1.56950

Density：

1.421±0.06 g/cm3

Melting Point：

140 °C (decomp)

Boiling Point：

444.5±38.0 °C(Predicted)

Flash Point：

222.6ºC

Refractive Index：

1.709

PKA：

1.52±0.30

Computed Properties

Molecular Weight:176.17
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.058577502
Monoisotopic Mass:176.058577502
Topological Polar Surface Area:66
Heavy Atom Count:13
Complexity:220
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 99459-47-9

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Guide of 1H-Benzimidazole-2-carboxylicacid,5-methyl-(9CI)

Basic Attributes
Characteristics
Computed Properties
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