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N-Tridecanoic acid 98%

CAT: 0286-T20845-02Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-T20845-02Size:25 g
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CAS Number
638-53-9
Synonyms
N-Tridecylic acid
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00002741
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Tridecanoic acid

Tridecanoic acid is a C13 straight-chain saturated fatty acid. It has a role as a plant metabolite. It is a long-chain fatty acid and a straight-chain saturated fatty acid. It is a conjugate acid of a tridecanoate.

CAS Number638-53-9
PubChem CID12530
IUPAC Nametridecanoic acid
Molecular FormulaC13H26O2
Molecular Weight214.34
XLogP4.7
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count11
Heavy Atom Count15
Formal Charge0
Complexity143
SMILES
CCCCCCCCCCCCC(=O)O
InChI
InChI=1S/C13H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H,14,15)
InChIKey
SZHOJFHSIKHZHA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tridecanoic acid
CAS: 638-53-9
CID: 12530
Formula: C13H26O2
MW: 214.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight214.34
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count11
Exact Mass214.193280068
Monoisotopic Mass214.193280068
Topological Polar Surface Area37.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity143
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes