Home Other Building Blocks 6-hydroxy-5,5-bis(hydroxymethyl)hexanoic acid

6-hydroxy-5,5-bis(hydroxymethyl)hexanoic acid

CAS No.:
98561-06-9
Catalog Number:
AG01BCY7
Molecular Formula:
C8H16O5
Molecular Weight:
192.2096
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BCY7
Chemical Name:
6-hydroxy-5,5-bis(hydroxymethyl)hexanoic acid
CAS Number:
98561-06-9
Molecular Formula:
C8H16O5
Molecular Weight:
192.2096
MDL Number:
MFCD20648327
IUPAC Name:
6-hydroxy-5,5-bis(hydroxymethyl)hexanoic acid
InChI:
InChI=1S/C8H16O5/c9-4-8(5-10,6-11)3-1-2-7(12)13/h9-11H,1-6H2,(H,12,13)
InChI Key:
RINDELCAMNEYKX-UHFFFAOYSA-N
SMILES:
OCC(CCCC(=O)O)(CO)CO
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
192.211g/mol
Monoisotopic Mass:
192.1g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  
Properties