4-((Dimethylamino)methyl)-2-methyl-1H-benzo[d]imidazol-5-ol
Basic information
- CAS
101018-70-6- Standard SMILES
Cc1nc2c(CN(C)C)c(O)ccc2[nH]1- InChIKey
KOXFMYCKLMXBLJ-UHFFFAOYSA-N- Molecular formula
- C11H15N3O
- Average molar mass
- 205.26 g/mol
- Monoisotopic mass
- 205.12151211
Names & identifiers
- Preferred name
- 4-((Dimethylamino)methyl)-2-methyl-1H-benzo[d]imidazol-5-ol
- IUPAC
- 4-[(dimethylamino)methyl]-2-methyl-1H-benzimidazol-5-ol
- English name
- 1H-BenziMidazol-5-ol, 4-[(diMethylaMino)Methyl]-2-Methyl-
- Molecular formula
- C11H15N3O
- Molecular weight
- 205.26
Names & synonyms
101018-70-64-((Dimethylamino)methyl)-2-methyl-1H-benzo[d]imidazol-5-ol2-methyl-4-(dimethylaminomethyl)-5-hydroxybenzimidazoleMFCD010898384-[(dimethylamino)methyl]-2-methyl-1H-benzimidazol-5-ol1H-Benzimidazol-5-ol, 4-[(dimethylamino)methyl]-2-methyl-7-((Dimethylamino)methyl)-2-methyl-1H-benzo[d]imidazol-6-ol1H-Benzimidazol-6-ol, 7-[(dimethylamino)methyl]-2-methyl-CHEMBL2070835CBMicro_0380364-[(Dimethylamino)methyl]-2-methyl-1H-benzo[d]imidazol-5-ol4-[(dimethylamino)methyl]-2-methyl-1H-1,3-benzodiazol-5-ol
Show more names
Oprea1_527435Oprea1_685603Oprea1_773906SCHEMBL2233005SCHEMBL2233013DTXSID20353989BDBM50389824AKOS016009286
Database identifiers
- CAS
101018-70-6- PubChem CID
- 761003
- DTXSID
DTXSID20353989- ChEMBL
CHEMBL2070835- Nikkaji
- J2.747.632E
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 52.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- Light yellow to yellow Solid
- InChI
- InChI=1S/C11H15N3O/c1-7-12-9-4-5-10(15)8(6-14(2)3)11(9)13-7/h4-5,15H,6H2,1-3H3,(H,12,13)
- InChIKey
- KOXFMYCKLMXBLJ-UHFFFAOYSA-N
- SMILES
- C1(C)NC2=C(CN(C)C)C(O)=CC=C2N=1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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