(1-((2,6-Difluorophenyl)methyl)-4-methylbenzimidazol-2-yl)methan-1-ol

HCID 468845

Basic information

CAS
199594-81-5
Standard SMILES
Cc1cccc2c1nc(CO)n2Cc1c(F)cccc1F
InChIKey
ICUYCZJMCOJKBO-UHFFFAOYSA-N
Molecular formula
C16H14F2N2O
Average molar mass
288.29 g/mol
Monoisotopic mass
288.10741951

Names & identifiers

Preferred name
(1-((2,6-Difluorophenyl)methyl)-4-methylbenzimidazol-2-yl)methan-1-ol
IUPAC
[1-[(2,6-difluorophenyl)methyl]-4-methylbenzimidazol-2-yl]methanol
English name
(1-((2,6-Difluorophenyl)methyl)-4-methylbenzimidazol-2-yl)methan-1-ol
Molecular formula
C16H14F2N2O
Molecular weight
288.29

Names & synonyms

199594-81-5(1-((2,6-Difluorophenyl)methyl)-4-methylbenzimidazol-2-yl)methan-1-ol1-(2,6-Difluorobenzyl)-2-(hydroxymethyl)-4-methylbenzimidazole[1-[(2,6-difluorophenyl)methyl]-4-methylbenzimidazol-2-yl]methanol1H-Benzimidazole-2-methanol, 1-((2,6-difluorophenyl)methyl)-4-methyl-(1-(2,6-Difluorobenzyl)-4-methyl-1H-benzo[d]imidazol-2-yl)methanol1H-Benzimidazole-2-methanol, 1-[(2,6-difluorophenyl)methyl]-4-methyl-ICUYCZJMCOJKBO-UHFFFAOYSA-NCHEMBL341387SCHEMBL5203556DTXSID201737401-(2,6-Difluorobenzyl)-2-Hydroxymethyl-4-Methylbenzimidazole
Show more names
[1-[(2,6-difluorophenyl)methyl]-4-methyl-benzimidazol-2-yl]methanol{1-[(2,6-Difluorophenyl)methyl]-4-methyl-1H-1,3-benzimidazol-2-yl}methanol

Database identifiers

CAS
199594-81-5
PubChem CID
468845
DTXSID
DTXSID20173740
ChEMBL
CHEMBL341387
Nikkaji
J925.397A

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
21

Physicochemical properties

Boiling point
470.8 · 470.8±45.0 °C(Predicted)
Density
1.29 · 1.29±0.1 g/cm3(Predicted)
pka
13.67 · 13.67±0.10(Predicted)

Chemistry & industry

Suppliers2 total

HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]

Related reactions

5 records

Compound notes

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