Stearonitrile - CAS 638-65-3

Catalog:	BB032304
Product Name:	Stearonitrile
CAS:	638-65-3
Synonyms:	octadecanenitrile

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Computed Properties

IUPAC Name:	octadecanenitrile
Description:	Stearonitrile (CAS# 638-65-3 ) is a useful research chemical.
Molecular Weight:	265.48
Molecular Formula:	C18H35N
Canonical SMILES:	CCCCCCCCCCCCCCCCCC#N
InChI:	InChI=1S/C18H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-17H2,1H3
InChI Key:	RHSBIGNQEIPSCT-UHFFFAOYSA-N
Boiling Point:	274 °C / 100 mmHg (lit.)
Melting Point:	41 °C
Density:	0.818 g/cm³
Appearance:	Liquid
MDL:	MFCD00001947
LogP:	6.77148

Publication Number	Title	Priority Date
JP-2021127505-A	Metal paste for joining, bonded body, semiconductor device, and manufacturing method of bonded body	20200214
JP-2021127506-A	Metal paste for joining, bonded body, semiconductor device, and manufacturing method of bonded body	20200214
JP-2021116338-A	Organic friction modifier	20200124
JP-2021097064-A	A substrate having a metal paste, a conductor, and a through electrode, and a method for manufacturing the same.	20191213
JP-2021097072-A	Manufacturing method of semiconductor devices	20191213

PMID	Publication Date	Title	Journal
17027948	20061101	Phase behaviour of stearic acid-stearonitrile mixtures. A thermodynamic study in bulk and at the air-water interface	Chemistry and physics of lipids
16913791	20060824	Sum frequency generation study of Langmuir Blodgett film architecture	The journal of physical chemistry. B
15210362	20040801	Phase behaviour and morphology of binary mixtures of DPPC with stearonitrile, stearic acid, and octadecanol at the air-water interface	Chemistry and physics of lipids

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GHS Hazard Statement:	H312 (92.68%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Precautionary Statement:	P261, P271, P280, P302+P352, P304+P312, P304+P340, P312, P322, P363, and P501
Signal Word:	Warning

Complexity:	201
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	265.276950121
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	265.276950121
Rotatable Bond Count:	15
Topological Polar Surface Area:	23.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	8