112-37-8
Product Name:
Hendecanoic acid
Formula:
C11H22O2
Synonyms:
1-Decanecarboxylic acid;Hendecanoic acid;Undecanoic acid
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Undecanoic acid is a white crystalline solid. Insoluble in water. Specific gravity 0.85. Hence floats on water. |
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Boiling Point | 442.2 °F at 160 mmHg (USCG, 1999) |
Melting Point | 83.3 °F (USCG, 1999) |
Flash Point | greater than 230 °F (USCG, 1999) |
Solubility | 0.0522 mg/mL |
Density | 0.891 (USCG, 1999) - Less dense than water; will float |
LogP | 4.42 |
Refractive Index | 1.4355 (30°) |
Collision Cross Section | 148.87 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)] |
Kovats Retention Index | 1460 1488 1493 1469 1445 1474 |
Chemical Classes | Other Classes -> Organic Acids |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. 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. Continuerinsing. P405:Store locked up. |
COMPUTED DESCRIPTORS
Molecular Weight | 186.29 g/mol |
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XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 9 |
Exact Mass | 186.161979940 g/mol |
Monoisotopic Mass | 186.161979940 g/mol |
Topological Polar Surface Area | 37.3 Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 121 |
Isotope Atom Count | 0 |
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 |
PRODUCT INTRODUCTION
description
Undecanoic acid is a white crystalline solid. Insoluble in water. Specific gravity 0.85. Hence floats on water.