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89149-91-7 | Oxazole, 5-(bromomethyl)-2-methyl-4-phenyl-
CAS No: 89149-91-7 Catalog No: AG003WT5 MDL No:
Product Description
Catalog Number:
AG003WT5
Chemical Name:
Oxazole, 5-(bromomethyl)-2-methyl-4-phenyl-
CAS Number:
89149-91-7
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
IUPAC Name:
5-(bromomethyl)-2-methyl-4-phenyl-1,3-oxazole
InChI:
InChI=1S/C11H10BrNO/c1-8-13-11(10(7-12)14-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChI Key:
LVGYIPQRAINTMA-UHFFFAOYSA-N
SMILES:
BrCc1oc(nc1c1ccccc1)C
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.995g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.111g/mol
Monoisotopic Mass:
250.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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