Palmitic Acid-d2

CAT: 1596-AR-F09707-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-F09707-01Size:10 Units

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CAS Number

62689-96-7

Molecular Formula

C16H30D2O2

Molecular Weight

258.44

API Name

Fatty acid

Chemical Information

Hexadecanoic-2,2-d2 acid

See also: Palmitic-2,2-D2 acid (annotation moved to).

CAS Number	62689-96-7
PubChem CID	12358526
IUPAC Name	2,2-dideuteriohexadecanoic acid
Molecular Formula	C16H32O2
Molecular Weight	258.44
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])(CCCCCCCCCCCCCC)C(=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)/i15D2

InChIKey

IPCSVZSSVZVIGE-DOBBINOXSA-N

Chemical Structure

2D Structure

CAS: 62689-96-7

CID: 12358526

Formula: C16H32O2

MW: 258.44

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	258.44
XLogP3	6.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	14
Exact Mass	258.252783751
Monoisotopic Mass	258.252783751
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	178
Isotope Atom Count	2
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-P30248-01	Palmitic Acid-d4
AR-F09706-01	Dodecanoic Acid-d2 (Lauric Acid-d2)
AR-F09709-01	Stearic Acid-d2
AR-F11034-01	Fumaric Acid-d2
AR-P33563-01	4-Hydroxyphenylpyruvic Acid-d2
AR-G02210-01	Gibberellin Acid (GA3) -d2
AR-P03342-01	4-Pyridoxic Acid-D2
AR-A01929-01	5-Aminolevulinic-d2 Acid HCl
AR-B06700-01	Benzoic-2,4-d2 Acid