Home Other Building Blocks 5-(but-3-en-1-yloxy)pentanoic acid

5-(but-3-en-1-yloxy)pentanoic acid

CAS No.:
1039945-25-9
Catalog Number:
AG01A4PF
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A4PF
Chemical Name:
5-(but-3-en-1-yloxy)pentanoic acid
CAS Number:
1039945-25-9
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
MDL Number:
MFCD11197689
IUPAC Name:
5-but-3-enoxypentanoic acid
InChI:
InChI=1S/C9H16O3/c1-2-3-7-12-8-5-4-6-9(10)11/h2H,1,3-8H2,(H,10,11)
InChI Key:
QSCMUZIHJCWEHH-UHFFFAOYSA-N
SMILES:
C=CCCOCCCCC(=O)O
Properties
Complexity:
132  
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:
8  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties