Home Carboxys 3-(Benzyloxymethyl)cyclobutanecarboxylic acid

3-(Benzyloxymethyl)cyclobutanecarboxylic acid

CAS No.:
1363381-57-0
Catalog Number:
AG0011OC
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$614
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Product Description
Catalog Number:
AG0011OC
Chemical Name:
3-(Benzyloxymethyl)cyclobutanecarboxylic acid
CAS Number:
1363381-57-0
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
MDL Number:
MFCD20926178
IUPAC Name:
3-(phenylmethoxymethyl)cyclobutane-1-carboxylic acid
InChI:
InChI=1S/C13H16O3/c14-13(15)12-6-11(7-12)9-16-8-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H,14,15)
InChI Key:
XHFZODBRACUFTI-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(C1)COCc1ccccc1
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.11g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.268g/mol
Monoisotopic Mass:
220.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties