5-Methyl-N,N-dipropyl-2-benzoxazolamine
Basic information
- CAS
1373348-99-2- Standard SMILES
CCCN(CCC)c1nc2cc(C)ccc2o1- InChIKey
POLWVQVUGRDKOB-UHFFFAOYSA-N- Molecular formula
- C14H20N2O
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.15756327
Names & identifiers
- Preferred name
- 5-Methyl-N,N-dipropyl-2-benzoxazolamine
- IUPAC
- 5-methyl-N,N-dipropyl-1,3-benzoxazol-2-amine
Names & synonyms
5-Methyl-N,N-dipropyl-2-benzoxazolamine5-methyl-N,N-dipropyl-1,3-benzoxazol-2-amineDTXSID2012791811373348-99-2
Database identifiers
- CAS
1373348-99-2- PubChem CID
- 57409293
- DTXSID
DTXSID201279181- Nikkaji
- J3.066.646A
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 228
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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