Isodecanol

CAT: 1596-AR-D01316-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-D01316-02Size:25 Units

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

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CAS Number

25339-17-7

Synonyms

8-methylnonan-1-ol; Exxal 10; Isodecyl Alcohol; Isodecanol

Molecular Formula

C10H22O

Molecular Weight

158.29

API Name

Decanol

Chemical Information

Isodecanol

Isodecyl alcohol is a colorless liquid with a mild alcohol odor. Floats on water. (USCG, 1999)

CAS Number	25339-17-7
PubChem CID	32898
IUPAC Name	8-methylnonan-1-ol
Molecular Formula	C10H22O
Molecular Weight	158.28
XLogP	3.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
Heavy Atom Count	11
Formal Charge	0
Complexity	69

SMILES

CC(C)CCCCCCCO

InChI

InChI=1S/C10H22O/c1-10(2)8-6-4-3-5-7-9-11/h10-11H,3-9H2,1-2H3

InChIKey

PLLBRTOLHQQAQQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 25339-17-7

CID: 32898

Formula: C10H22O

MW: 158.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	158.28
XLogP3	3.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
Exact Mass	158.167065321
Monoisotopic Mass	158.167065321
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	69.3
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
FI168527	Isodecanol
90189	Isodecanol pure, 98%