1,6-Diacetoxyhexane

CAT: 0024-sc-273657Size: 50 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-273657Size:50 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

6222-17-9

Chemical Information

1,6-Hexanediol, 1,6-diacetate

CAS Number	6222-17-9
PubChem CID	80356
IUPAC Name	6-acetyloxyhexyl acetate
Molecular Formula	C10H18O4
Molecular Weight	202.25
XLogP	1.4
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Heavy Atom Count	14
Formal Charge	0
Complexity	157

SMILES

CC(=O)OCCCCCCOC(=O)C

InChI

InChI=1S/C10H18O4/c1-9(11)13-7-5-3-4-6-8-14-10(2)12/h3-8H2,1-2H3

InChIKey

ZMFWEWMHABZQNB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6222-17-9

CID: 80356

Formula: C10H18O4

MW: 202.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	202.25
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Exact Mass	202.12050905
Monoisotopic Mass	202.12050905
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	157
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-486024	2,5-Diacetoxyhexane
sc-220153	Sucrose-1,1,6,6,6',6'-d6
sc-220153A	Sucrose-1,1,6,6,6',6'-d6
sc-287269	1,6-Diaminohexane-1,1,6,6-d4
sc-485222	1,10-Diacetoxydecane
sc-485496	1,7-Diacetoxyheptane
sc-287271	1,6,20,25-Tetraaza[6.1.6.1]paracyclophane
sc-351257A	6-amino-1λ{6}-benzothiophene-1,1-dione
sc-351257	6-amino-1λ{6}-benzothiophene-1,1-dione
sc-474926	1′,6,6′-Trichloro Sucrose