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Lithium 12-hydroxystearate

CAT: 0286-L04160Size: 1K gDry Ice: NoHazardous: No
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CAT#:0286-L04160Size:1K g
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CAS Number
7620-77-1
Pictogram
07 - Irritant
UDF Signal Word
Warning
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

Lithium hydroxystearate
CAS Number7620-77-1
PubChem CID23668746
IUPAC Namelithium 12-hydroxyoctadecanoate
Molecular FormulaC18H35LiO3
Molecular Weight306.4
Topological Polar Surface Area60.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Heavy Atom Count22
Formal Charge0
Complexity234
SMILES
[Li+].CCCCCCC(CCCCCCCCCCC(=O)[O-])O
InChI
InChI=1S/C18H36O3.Li/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h17,19H,2-16H2,1H3,(H,20,21);/q;+1/p-1
InChIKey
FPLIHVCWSXLMPX-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Lithium hydroxystearate
CAS: 7620-77-1
CID: 23668746
Formula: C18H35LiO3
MW: 306.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight306.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Exact Mass306.27462341
Monoisotopic Mass306.27462341
Topological Polar Surface Area60.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity234
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes