Basic information
- CAS
54237-83-1- Standard SMILES
Cc1cccc(C)c1NCC1OCCO1- InChIKey
GGNYAVVATITVAW-UHFFFAOYSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.12592878
Names & identifiers
- Preferred name
- 1,3-Dioxolane-2-methanamine, N-(2,6-dimethylphenyl)-
- IUPAC
- N-(1,3-dioxolan-2-ylmethyl)-2,6-dimethylaniline
- English name
- N-(2,6-Dimethylphenyl)-1,3-dioxolane-2-methanamine
- Molecular formula
- C12H17NO2
- Molecular weight
- 207.27
Names & synonyms
1,3-Dioxolane-2-methanamine, N-(2,6-dimethylphenyl)-54237-83-1DTXSID7068924RefChem:414906DTXCID0041646n-(1,3-dioxolan-2-ylmethyl)-2,6-dimethylanilineN-(2,6-Dimethylphenyl)-1,3-dioxolane-2-methanamineN-[(1,3-dioxolan-2-yl)methyl]-2,6-dimethylanilineSCHEMBL11796633DB-3084701,3-dioxolan-2-ylmethyl-2,6-dimethylanilineN-(1,3Dioxolan-2-ylmethyl)-2,6-dimethylaniline
Database identifiers
- CAS
54237-83-1- PubChem CID
- 104710
- DTXSID
DTXSID7068924- Nikkaji
- J429.250B
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3-Dioxolane-2-methanamine, N-(2,6-dimethylphenyl)- (54237-83-1)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Dioxolane-2-methanamine, N-(2,6-dimethylphenyl)-: INACTIVE
Related reactions
8 records
Compound notes
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