4-Methyl-2-undecyl-2-oxazoline-4-methanol
Basic information
- CAS
2581-46-6- Standard SMILES
CCCCCCCCCCCC1=NC(C)(CO)CO1- InChIKey
JMQRHKPPXPCTGP-UHFFFAOYSA-N- Molecular formula
- C16H31NO2
- Average molar mass
- 269.42 g/mol
- Monoisotopic mass
- 269.23547923
Names & identifiers
- Preferred name
- 4-Methyl-2-undecyl-2-oxazoline-4-methanol
- IUPAC
- (4-methyl-2-undecyl-5H-1,3-oxazol-4-yl)methanol
- English name
- 4-methyl-2-undecyl-2-oxazoline-4-methanol
- Molecular formula
- C16H31NO2
- Molecular weight
- 269.42
Names & synonyms
2581-46-6NSC17729(4-methyl-2-undecyl-4,5-dihydrooxazol-4-yl)methanol4-Methyl-2-undecyl-2-oxazoline-4-methanolEINECS 219-953-04-oxazolemethanol, 4,5-dihydro-4-methyl-2-undecyl-NSC 177294,5-Dihydro-4-methyl-2-undecyl-4-oxazolemethanolSCHEMBL6765894-Oxazolemethanol,4,5-dihydro-4-methyl-2-undecyl-(4-methyl-2-undecyl-4,5-dihydro-1,3-oxazol-4-yl)methanolDTXSID501238645
Show more names
NSC-17729DS-015352NS00046147(4-methyl-2-undecyl-5H-oxazol-4-yl)methanol4-hydroxymethyl-4-methyl-2-undecyl-2oxazoline4-hydroxymethyl-4-methyl-2-undecyl-2-oxazoline
Database identifiers
- CAS
2581-46-6- PubChem CID
- 73507
- DTXSID
DTXSID501238645- EC Number
- 219-953-0
- Nikkaji
- J192.092H
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 265
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Related reactions
3 records
Compound notes
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