Structure

N-Octane-d18

CAS
17252-77-6
Catalog Number
ACM17252776
Category
Other Products
Molecular Weight
132.34
Molecular Formula
C8D18

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Specification

Synonyms
octadecadeuterio-octane;octadecadeutero-octane;N-OCTANE-D18;OCTANE-D18;(2H18)octane;OCTANE-D18 98 PLUS ATOM % D;OCTANE-D18, 98+ ATOM % D;n-Octane-d18(Isotopic)
Boiling Point
126°C
Melting Point
-57°C
Flash Point
60°F
Density
0.815g/mL at 25°C(lit.)
Hazard Statements
F,Xn,N
Safety Description
9-16-29-33-62-61-60
Supplemental Hazard Statements
H400-H225-H304-H315-H336-H410
Symbol
GHS02,GHS07,GHS08,GHS09
What is the molecular formula of N-Octane-d18?

The molecular formula of N-Octane-d18 is C8H18.

What is the molecular weight of N-Octane-d18?

The molecular weight of N-Octane-d18 is 132.34 g/mol.

What is the IUPAC name of N-Octane-d18?

The IUPAC name of N-Octane-d18 is 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-octadecadeuteriooctane.

What is the InChI of N-Octane-d18?

The InChI of N-Octane-d18 is InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2.

What is the InChIKey of N-Octane-d18?

The InChIKey of N-Octane-d18 is TVMXDCGIABBOFY-VAZJTQEUSA-N.

What is the canonical SMILES of N-Octane-d18?

The canonical SMILES of N-Octane-d18 is CCCCCCCC.

What is the CAS number of N-Octane-d18?

The CAS number of N-Octane-d18 is 17252-77-6.

What is the XLogP3 value of N-Octane-d18?

The XLogP3 value of N-Octane-d18 is 3.9.

What is the hydrogen bond donor count of N-Octane-d18?

The hydrogen bond donor count of N-Octane-d18 is 0.

Is N-Octane-d18 a canonicalized compound?

Yes, N-Octane-d18 is a canonicalized compound.

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