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19312-06-2 | 4,4-Dimethyl-2-phenyl-2-oxazoline
CAS No: 19312-06-2 Catalog No: AG003KFW MDL No:
Product Description
Catalog Number:
AG003KFW
Chemical Name:
4,4-Dimethyl-2-phenyl-2-oxazoline
CAS Number:
19312-06-2
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
IUPAC Name:
4,4-dimethyl-2-phenyl-5H-1,3-oxazole
InChI:
InChI=1S/C11H13NO/c1-11(2)8-13-10(12-11)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChI Key:
UGNSMKDDFAUGFT-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)c1ccccc1
NSC Number:
150924
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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