6-Hydroxytetradecanoic acid

CAT: 0127-OR1063379-03Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1063379-03Size:250 mg

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CAS Number

1747-18-8

Purity

98%

Smiles

CCCCCCCCC (O) CCCCC (O) =O

Chemical Information

6-Hydroxytetradecanoic acid

6-hydroxy-tetradecanoic acid is a long-chain fatty acid.

CAS Number	1747-18-8
PubChem CID	5312751
IUPAC Name	6-hydroxytetradecanoic acid
Molecular Formula	C14H28O3
Molecular Weight	244.37
XLogP	4.1
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	12
Heavy Atom Count	17
Formal Charge	0
Complexity	180

SMILES

CCCCCCCCC(CCCCC(=O)O)O

InChI

InChI=1S/C14H28O3/c1-2-3-4-5-6-7-10-13(15)11-8-9-12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)

InChIKey

XQMCCPUZOKUEHG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1747-18-8

CID: 5312751

Formula: C14H28O3

MW: 244.37

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	244.37
XLogP3	4.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	12
Exact Mass	244.20384475
Monoisotopic Mass	244.20384475
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	180
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
OR1011012-01	3-Hydroxytetradecanoic Acid
OR1063374-01	8-Hydroxytetradecanoic acid
OR1010489-01	2-Hydroxytetradecanoic Acid
OR1067713-01	10-Hydroxytetradecanoic acid
OR82436-01	14-Hydroxytetradecanoic acid
OR1067900-01	13-Hydroxytetradecanoic acid
OR1055005-01	9-Hydroxytetradecanoic acid
OR1060243-01	(S) -3-Hydroxytetradecanoic acid
PC1002678-01	6,6,6-Trifluorohexanoic acid
OR1057749-01	6,6'-Disulfanediyldihexanoic acid

Catalog	Name
HY-W108232	14-Hydroxytetradecanoic acid
HY-W009544-01	3-Hydroxytetradecanoic acid
MBS392347-01	2-Hydroxytetradecanoic Acid
440180	8-Hydroxytetradecanoic Acid
MBS392349	(R) -3-Hydroxytetradecanoic Acid
HY-W012017R	2-Hydroxytetradecanoic acid (Standard)
440181	8-Hydroxytetradecanoic Acid-d11
MBS392350	(S) -3-Hydroxytetradecanoic Acid
MBS6023241-01	D, L-a-Hydroxymyristic Acid (2-Hydroxytetradecanoic Acid)
15845021-100g	6-Aminohexanoic acid (6-Aminocaproic acid)