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Basic information
- Standard SMILES
CC1=N[C@@H](Cc2ccccc2)CO1- InChIKey
XFGDWXDHKJEUEA-NSHDSACASA-N- Molecular formula
- C11H13NO
- Average molar mass
- 175.231 g/mol
- Monoisotopic mass
- 175.09971404
Names & identifiers
- Preferred name
- AG-H-02521
- IUPAC
- (4S)-4-Benzyl-2-methyl-4,5-dihydro-1,3-oxazole
- English name
- (S)-4-BENZYL-2-METHYL-2-OXAZOLINE
- Molecular formula
- C11H13NO
- Molecular weight
- 175.23
Names & synonyms
(S)-4-Benzyl-2-methyloxazoline(S)-4-BENZYL-2-METHYL-2-OXAZOLINEOxazole, 4,5-dihydro-2-methyl-4-(phenylmethyl)-, (4S)-
Database identifiers
- CAS
75866-72-7- PubChem CID
- 5325154
- DTXSID
DTXSID00415993- EC Number
- 633-314-7
- Nikkaji
- J643.494K
Properties
Physicochemical properties
- Boiling point
- 221 °C · 221 °C(lit.)
- Density
- 1.05 g/mL · 1.05 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.525(lit.)
- Flash point
- 214 °F · 214 °F
- pka
- 5.77 · 5.77±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-43
- Safety Statements
- 36 · 36/37
- WGK Germany
- 2 · 2
Safety & regulation
Safety data
- wgk
- 2
- risk_code
- 22-43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 36/37
- Hazard statements
- H302-H317
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
SIGMA—
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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