Home Other Building Blocks 3-methyl-4-(3-methylphenyl)azetidin-2-one, Mixture of diastereomers

3-methyl-4-(3-methylphenyl)azetidin-2-one, Mixture of diastereomers

CAS No.:
1864295-42-0
Catalog Number:
AG01DZ5X
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
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Product Description
Catalog Number:
AG01DZ5X
Chemical Name:
3-methyl-4-(3-methylphenyl)azetidin-2-one, Mixture of diastereomers
CAS Number:
1864295-42-0
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD31615634
IUPAC Name:
3-methyl-4-(3-methylphenyl)azetidin-2-one
InChI:
InChI=1S/C11H13NO/c1-7-4-3-5-9(6-7)10-8(2)11(13)12-10/h3-6,8,10H,1-2H3,(H,12,13)
InChI Key:
NDTXGGASGFQNBE-UHFFFAOYSA-N
SMILES:
O=C1NC(C1C)c1cccc(c1)C
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:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties