2-Decyltetradecanoic acid

CAT: 0127-OR1053326-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1053326-01Size:25 g

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

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CAS Number

93778-52-0

MDL Number

MFCD02682905

Purity

95%

Smiles

CCCCCCCCCCCCC (CCCCCCCCCC) C (O) =O

Chemical Information

Decyltetradecanoic acid

CAS Number	93778-52-0
PubChem CID	175556
IUPAC Name	2-decyltetradecanoic acid
Molecular Formula	C24H48O2
Molecular Weight	368.6
XLogP	10.8
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	21
Heavy Atom Count	26
Formal Charge	0
Complexity	288

SMILES

CCCCCCCCCCCCC(CCCCCCCCCC)C(=O)O

InChI

InChI=1S/C24H48O2/c1-3-5-7-9-11-13-14-16-18-20-22-23(24(25)26)21-19-17-15-12-10-8-6-4-2/h23H,3-22H2,1-2H3,(H,25,26)

InChIKey

OYXVDHZABMXCMX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 93778-52-0

CID: 175556

Formula: C24H48O2

MW: 368.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	368.6
XLogP3	10.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	21
Exact Mass	368.365430770
Monoisotopic Mass	368.365430770
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	288
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
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