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70502-02-2

70502-02-2 | Oxazole, 4-(bromomethyl)-5-methyl-2-phenyl-

CAS No: 70502-02-2 Catalog No: AG005IGU MDL No:

Product Description

Catalog Number:
AG005IGU
Chemical Name:
Oxazole, 4-(bromomethyl)-5-methyl-2-phenyl-
CAS Number:
70502-02-2
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
IUPAC Name:
4-(bromomethyl)-5-methyl-2-phenyl-1,3-oxazole
InChI:
InChI=1S/C11H10BrNO/c1-8-10(7-12)13-11(14-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChI Key:
QPKHTIIMVBBLJA-UHFFFAOYSA-N
SMILES:
BrCc1nc(oc1C)c1ccccc1

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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