Palmitic Acid-d4

CAT: 1596-AR-P30248-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P30248-02Size:25 Units

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CAS Number

75736-47-9

Molecular Formula

C16H28D4O2

Molecular Weight

260.45

API Name

Palmitic acid

Chemical Information

Hexadecanoic-5,5,6,6-D4 acid

CAS Number	75736-47-9
PubChem CID	90475915
IUPAC Name	5,5,6,6-tetradeuteriohexadecanoic acid
Molecular Formula	C16H32O2
Molecular Weight	260.45
XLogP	6.4
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	14
Heavy Atom Count	18
Formal Charge	0
Complexity	178

SMILES

[2H]C([2H])(CCCCCCCCCC)C([2H])([2H])CCCC(=O)O

InChI

InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i11D2,12D2

InChIKey

IPCSVZSSVZVIGE-AREBVXNXSA-N

Chemical Structure

2D Structure

CAS: 75736-47-9

CID: 90475915

Formula: C16H32O2

MW: 260.45

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	260.45
XLogP3	6.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	14
Exact Mass	260.265337243
Monoisotopic Mass	260.265337243
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	178
Isotope Atom Count	4
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
AR-P29457-01	Palmitic Acid
AR-F09707-01	Palmitic Acid-d2
AR-F09712-01	Docosanoic Acid-d4 (Behenic Acid-d4)
AR-C02625-01	Tauroursodeoxycholic-d4 Acid (Tauroursodiol-d4)
AR-A02672-01	Acetylsalicylic Acid-d4 (Aspirin-d4)
AR-F10724-01	Folinic Acid-d4 (Leucovorin-d4)
AR-F01966-01	Folinic Acid-d4 (Leucovorin-d4)
AR-I01645-01	Ioxitalamic Acid-d4
AR-C02640-01	Taurodeoxycholic-d4 Acid
AR-A02624-01	Ascorbic Acid-d4