1-Bromohexadecane - CAS 112-82-3

Name: 1-Bromohexadecane
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	1-bromohexadecane
Description:	Applications: 1-Bromohexadecane is used in the preparation of soluble carbon nano-onions by covalent functionalization with hexadecyl chains. It is also used to synthesize [2-(methacryloyloxy)ethyl]dimethylhexadecylammonium bromide monomer, required for the synthesis of novel methacrylate based adsorbents.
Molecular Weight:	305.34
Molecular Formula:	C16H33Br
Canonical SMILES:	CCCCCCCCCCCCCCCCBr
InChI:	InChI=1S/C16H33Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3
InChI Key:	HNTGIJLWHDPAFN-UHFFFAOYSA-N
Boiling Point:	336 °C
Melting Point:	17.3 °C
Purity:	95 %
Density:	0.999 g/cm³
Appearance:	Clear to yellow liquid
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00000230
LogP:	6.86260
Refractive Index:	n20/D 1.461 (lit.)

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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22369981	20120515	A method for estimating effective coalescence rates during emulsification from oil transfer experiments	Journal of colloid and interface science
22382855	20120507	Determination of endocrine-disrupting phenols in water samples by a new manual shaking-enhanced, ultrasound-assisted emulsification microextraction method	The Analyst
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Complexity:	123
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	304.17656
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	304.17656
Rotatable Bond Count:	14
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	9.2