3-Hydroxynonanoic Acid

CAT: 0572-TRC-H948785-25MGSize: 25 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-H948785-25MGSize:25 mg

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CAS Number

40165-87-5

Hazard Statement

Causes skin irritation.

Smiles

CCCCCCC(O)CC(=O)O

Molecular Formula

C9 H18 O3

Molecular Weight

174.24

InChI

InChI=1S/C9H18O3/c1-2-3-4-5-6-8(10)7-9(11)12/h8,10H,2-7H2,1H3,(H,11,12)

Additionnal Information

IUPAC name: 3-hydroxynonanoic acid

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

3-Hydroxynonanoic acid

()-3-Hydroxynonanoic acid is a carbonyl compound.

CAS Number	40165-87-5
PubChem CID	36599
IUPAC Name	3-hydroxynonanoic acid
Molecular Formula	C9H18O3
Molecular Weight	174.24
XLogP	2
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Heavy Atom Count	12
Formal Charge	0
Complexity	123

SMILES

CCCCCCC(CC(=O)O)O

InChI

InChI=1S/C9H18O3/c1-2-3-4-5-6-8(10)7-9(11)12/h8,10H,2-7H2,1H3,(H,11,12)

InChIKey

XBUXARJOYUQNTC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 40165-87-5

CID: 36599

Formula: C9H18O3

MW: 174.24

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	174.24
XLogP3	2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	174.125594432
Monoisotopic Mass	174.125594432
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	123
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

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Catalog	Name
H947235	8-Hydroxynonanoic Acid
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TRC-D491725-50G	3,3-Diphenylpropionic Acid
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TRC-D473915-25G	3,3-Dimethylglutaric Acid
TRC-D473915-10G	3,3-Dimethylglutaric Acid
TRC-D445368-50MG	3,3-Difluorocyclopentanecarboxylic Acid
TRC-D473520-25G	3,3-Dimethylbutyric Acid

Alternative Products

Catalog	Name
MBS392336-01	3-Hydroxynonanoic Acid
OR1063596-01	8-Hydroxynonanoic acid
OR1067726-01	2-Hydroxynonanoic acid
OR315586-01	9-Hydroxynonanoic acid
H16106	4-Hydroxynonanoic acid-g-lactone
440316-01	9- (3,4-Dimethyl-5-pentylfuran-2-yl) -9-hydroxynonanoic Acid Methyl Ester
34825450-01	3,3',5-Triiodothyroacetic acid, free acid
C7173-500	3,3-Dimethylglutaric acid
FAA96183-01	3,3-oxydipropanoic acid
HY-W016614	3,3'-Thiodipropanoic acid

3-Hydroxynonanoic Acid

Chemical Information

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