Home Other Building Blocks 3-(4-methoxyphenyl)cyclobutanone

3-(4-methoxyphenyl)cyclobutanone

CAS No.:
52498-02-9
Catalog Number:
AG00DKPO
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
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Product Description
Catalog Number:
AG00DKPO
Chemical Name:
3-(4-methoxyphenyl)cyclobutanone
CAS Number:
52498-02-9
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD11848455
IUPAC Name:
3-(4-methoxyphenyl)cyclobutan-1-one
InChI:
InChI=1S/C11H12O2/c1-13-11-4-2-8(3-5-11)9-6-10(12)7-9/h2-5,9H,6-7H2,1H3
InChI Key:
LXEFTIJELDKOQB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1CC(=O)C1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties