2-Dodecanol - CAS 10203-28-8

Catalog:	BB000756
Product Name:	2-Dodecanol
CAS:	10203-28-8
Synonyms:	dodecan-2-ol

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Computed Properties

IUPAC Name:	dodecan-2-ol
Description:	2-Dodecanol (CAS# 10203-28-8) is a useful research chemical.
Molecular Weight:	186.33
Molecular Formula:	C12H26O
Canonical SMILES:	CCCCCCCCCCC(C)O
InChI:	InChI=1S/C12H26O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h12-13H,3-11H2,1-2H3
InChI Key:	XSWSEQPWKOWORN-UHFFFAOYSA-N
Boiling Point:	252 °C at 760 mmHg, 129 °C / 12 mmHg
Melting Point:	19 °C
Purity:	95 %
Density:	0.829 g/mL at 20 °C (lit.)
Appearance:	Clear colorless liquid
MDL:	MFCD00004551
LogP:	3.89800

Publication Number	Title	Priority Date
US-2021189379-A1	Methods and systems and related compositions for mixtures separation with a solid matrix	20191223
WO-2021124267-A1	Endotoxin detection	20191220
EP-3838891-A1	Aldimines and uses thereof	20191219
WO-2021122594-A1	Aldimines and uses thereof	20191219
WO-2021125322-A1	Method for producing guerbet alcohol	20191218

PMID	Publication Date	Title	Journal
22840825	20120831	Analysis of phenolic pollutants in human samples by high performance capillary electrophoresis based on pretreatment of ultrasound-assisted emulsification microextraction and solidification of floating organic droplet	Journal of chromatography. A
22645504	20120101	Ultrasound-assisted emulsification microextraction based on solidification floating organic drop trace amounts of manganese prior to graphite furnace atomic absorption spectrometry determination	TheScientificWorldJournal
19810039	20091201	2-dodecanol (decyl methyl carbinol) inhibits hyphal formation and SIR2 expression in C. albicans	Journal of basic microbiology
18945435	20081121	Dispersive liquid-liquid microextraction method based on solidification of floating organic drop combined with gas chromatography with electron-capture or mass spectrometry detection	Journal of chromatography. A

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P321, P332+P313, and P362
Signal Word:	Warning

Complexity:	91.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.198365449
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	186.198365449
Rotatable Bond Count:	9
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	5.1