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51655-71-1 | 5-METHYL-2-PHENYL-1,3-OXAZOLE-4-CARBONYL CHLORIDE
CAS No: 51655-71-1 Catalog No: AG00DBIM MDL No:MFCD08271880
Product Description
Catalog Number:
AG00DBIM
Chemical Name:
5-METHYL-2-PHENYL-1,3-OXAZOLE-4-CARBONYL CHLORIDE
CAS Number:
51655-71-1
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD08271880
IUPAC Name:
5-methyl-2-phenyl-1,3-oxazole-4-carbonyl chloride
InChI:
InChI=1S/C11H8ClNO2/c1-7-9(10(12)14)13-11(15-7)8-5-3-2-4-6-8/h2-6H,1H3
InChI Key:
RWVAPUPMWDZLGV-UHFFFAOYSA-N
SMILES:
ClC(=O)c1nc(oc1C)c1ccccc1
NSC Number:
255236
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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