7-Hydroxyoctanoic acid

CAT: 0127-OR1071789-03Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1071789-03Size:250 mg

Selected

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

Quick Request Actions

CAS Number

17173-14-7

MDL Number

MFCD18642146

Purity

95%

Smiles

CC(CCCCCC(=O)O)O

Chemical Information

(+-)-7-Hydroxyoctanoic acid

found in serum & urine of patients with severe hypoglycemia

CAS Number	17173-14-7
PubChem CID	167627
IUPAC Name	7-hydroxyoctanoic acid
Molecular Formula	C8H16O3
Molecular Weight	160.21
XLogP	1.1
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	11
Formal Charge	0
Complexity	112

SMILES

CC(CCCCCC(=O)O)O

InChI

InChI=1S/C8H16O3/c1-7(9)5-3-2-4-6-8(10)11/h7,9H,2-6H2,1H3,(H,10,11)

InChIKey

OFCMTSZRXXFMBQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17173-14-7

CID: 167627

Formula: C8H16O3

MW: 160.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	160.21
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	160.109944368
Monoisotopic Mass	160.109944368
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	112
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
OR315581-01	8-Hydroxyoctanoic acid
BUP10960-01	3-Hydroxyoctanoic Acid
OR1023629-01	3-Hydroxyoctanoic Acid
OR1069933-01	(R) -3-Hydroxyoctanoic acid
OR1011887-01	5-Hydroxyoctanoic Acid Lactone
OR90529-01	7-Methoxy-7-oxoheptanoic acid
OR1049856-01	7- (7-Aminoheptanamido) heptanoic acid
BUP19811	7-Aminodeacetoxycephalosporanic acid
OR91293-01	7-Oxooctanoic acid
OR55219-01	7-Octenoic acid