Home Other Building Blocks 3-(4,4-dimethyloxolan-2-yl)propanoic acid

3-(4,4-dimethyloxolan-2-yl)propanoic acid

CAS No.:
404003-43-6
Catalog Number:
AG01BUBJ
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BUBJ
Chemical Name:
3-(4,4-dimethyloxolan-2-yl)propanoic acid
CAS Number:
404003-43-6
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
MDL Number:
MFCD20656682
IUPAC Name:
3-(4,4-dimethyloxolan-2-yl)propanoic acid
InChI:
InChI=1S/C9H16O3/c1-9(2)5-7(12-6-9)3-4-8(10)11/h7H,3-6H2,1-2H3,(H,10,11)
InChI Key:
QPJLDEFMRCZCEW-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1OCC(C1)(C)C
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.11g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.224g/mol
Monoisotopic Mass:
172.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties