Hexane-1,2,6-triol

CAT: 0127-OR80220-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR80220-01Size:25 g

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CAS Number

106-69-4

MDL Number

MFCD00002976

Purity

95%

Smiles

OCC(O)CCCCO

Chemical Information

1,2,6-Hexanetriol

1,2,6-Hexanetriol is an aliphatic alcohol.

CAS Number	106-69-4
PubChem CID	7823
IUPAC Name	hexane-1,2,6-triol
Molecular Formula	C6H14O3
Molecular Weight	134.17
XLogP	-0.7
Topological Polar Surface Area	60.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	9
Formal Charge	0
Complexity	56

SMILES

C(CCO)CC(CO)O

InChI

InChI=1S/C6H14O3/c7-4-2-1-3-6(9)5-8/h6-9H,1-5H2

InChIKey

ZWVMLYRJXORSEP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 106-69-4

CID: 7823

Formula: C6H14O3

MW: 134.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	134.17
XLogP3	-0.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	134.094294304
Monoisotopic Mass	134.094294304
Topological Polar Surface Area	60.7 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	56.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1020928	1,6-Hexane diisothiocyanate
OR1067358-01	Hexane-1,6-diamine xadipate
OR1066711-01	Dimethyl hexane-1,6-diyldicarbamate
OR1027133-01	1,6-Bis (Trimethylsilyl) Hexane
OR93663-01	Hexane-1,6-diamine dihydrochloride
PC107824	6-Iodo-1,1,1,2-tetrafluoro-2- (trifluoromethyl) hexane
OR1033745-01	Hexane-1,6-diyl dipropiolate
OR1030667	1,6-Bis (Dimethylamino) Hexane
OR1028504-01	1,6-Bis (Trichlorosilyl) Hexane
BUP06199	Hexane-1,6-diyldiphosphonic acid

Catalog	Name
TRC-B795835-25MG	6-Bromobenzene-1,2,4-triol
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HY-W010505-01	Hexane-1,6-diol
TRC-E585923-5G	1,6-Bis(2,3-epoxypropoxy)hexane
MDA13501-01	1,6-Bis (trimethoxysilyl) hexane
CCA03416	1,6-Bis (triethoxysilyl) hexane
HY-138327-01	1,6-Bis (mesyloxy) hexane
sc-223099	1,6-Bis (diphenylphosphino) hexane
B475500	1,6-Bis(maleimido)hexane
GTR19233165-01	1-Isothiocyanato-6- (methylsulfenyl) -hexane