11-Hydroxyheptadecanoic acid

CAT: 0127-OR1063451-03Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1063451-03Size:250 mg

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CAS Number

202206-89-1

Purity

98%

Smiles

CCCCCCC(O)CCCCCCCCCC(O)=O

Chemical Information

11-Hydroxyheptadecanoic acid

CAS Number	202206-89-1
PubChem CID	14454552
IUPAC Name	11-hydroxyheptadecanoic acid
Molecular Formula	C17H34O3
Molecular Weight	286.4
XLogP	6
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	15
Heavy Atom Count	20
Formal Charge	0
Complexity	216

SMILES

CCCCCCC(CCCCCCCCCC(=O)O)O

InChI

InChI=1S/C17H34O3/c1-2-3-4-10-13-16(18)14-11-8-6-5-7-9-12-15-17(19)20/h16,18H,2-15H2,1H3,(H,19,20)

InChIKey

QSGIINWYDRDLGB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 202206-89-1

CID: 14454552

Formula: C17H34O3

MW: 286.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	286.4
XLogP3	6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	15
Exact Mass	286.25079494
Monoisotopic Mass	286.25079494
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	216
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
MBS392364-01	3-Hydroxyheptadecanoic Acid
MBS392365-01	17-Hydroxyheptadecanoic Acid
TRC-H943070-750MG	rac-3-Hydroxyheptadecanoic Acid
013653	3-Hydroxyheptadecanoic Acid Methyl Ester
U788852	Undecanoic-11,11,11-d3 Acid
HY-W098051	11-Methoxy-11-oxoundecanoic acid
P144526	Hexadecanoic-11,11-d2 Acid
AR-L07479-01	11,11-D2-Linoleic acid
FB00994-01	11-Bromoundecanoic acid
HY-W142804	11-Hydroxyundecanoic acid