CAS 51655-71-1 5-Methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride (HCID 318530)

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Basic information

CAS: 51655-71-1
Standard SMILES: Cc1oc(-c2ccccc2)nc1C(=O)Cl
InChIKey: RWVAPUPMWDZLGV-UHFFFAOYSA-N
Molecular formula: C11H8ClNO2
Average molar mass: 221.64 g/mol
Monoisotopic mass: 221.02435618

Names & identifiers

Preferred name: 5-Methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride
IUPAC: 5-methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride
English name: 5-Methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride
Molecular formula: C11H8ClNO2
Molecular weight: 221.64

Names & synonyms

5-methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride51655-71-1MFCD082718805-Methyl-2-phenyloxazole-4-carbonyl chloride5-methyl-2-phenyl-oxazole-4-carbonyl chlorideNSC255236SCHEMBL893186DTXSID60312479RWVAPUPMWDZLGV-UHFFFAOYSA-NSBB096202AKOS025117127NSC-255236

Show more names

5-Methyl-2-phenyl-4-oxazolecarbonyl chloride4-Oxazolecarbonyl chloride, 5-methyl-2-phenyl-4-(Chlorocarbonyl)-5-methyl-2-phenyl-1,3-oxazole5-Methyl-2-phenyl-1,3-oxazole-4-carbonylchloride97%2-phenyl-5-Methyl-4-oxazolecarboxylic acid chloride5-Methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride 97%

PS-10719DB-0107805-Methyl-2-phenyloxazole-4-carbonylchloride5-methyl-2-phenyl-oxazole4-carbonyl chloride5-methyl-2-phenyl-4-oxazolecarboxylic acid chloride

Database identifiers

CAS: 51655-71-1
PubChem CID: 318530

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 43.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 241

Physicochemical properties

Melting point: 135 °C · 135 °C
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H312-H314-H332
Precautionary statements: 260 · P260-P261-P264-P270-P271-P280-P301+P312-P301+P330+P331-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P363-P405-P501
Hazard Codes: C
HS Code: 2934999090 · 2934999090

Safety & regulation

Safety data

hs_code: 2934999090
Signal word: Danger
Symbol(GHS): GHS05,GHS07
hazard_code: C
Hazard statements: H302-H312-H314-H332
Precautionary statements: P260-P261-P264-P270-P271-P280-P301+P312-P301+P330+P331-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P363-P405-P501