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Merck
CN

P-037

Supelco

Pentaerythritol tetranitrate solution

1000 μg/mL in acetonitrile, ampule of 1 mL, certified reference material, Cerilliant®

Synonym(s):

Pentaerythritol tetranitrate, PETN

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About This Item

Empirical Formula (Hill Notation):
C5H8N4O12
CAS Number:
78-11-5
Molecular Weight:
316.14
MDL number:
MFCD00058681
UNSPSC Code:
41116107
NACRES:
NA.24

Key Documents

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grade

certified reference material

Quality Level

300

feature

Snap-N-Spike®/Snap-N-Shoot®

packaging

ampule of 1 mL

manufacturer/tradename

Cerilliant®

concentration

1000 μg/mL in acetonitrile

application(s)

environmental

format

single component solution

storage temp.

−20°C

SMILES string

O=[N+]([O-])OCC(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO[N+]([O-])=O

InChI

1S/C5H8N4O12/c10-6(11)18-1-5(2-19-7(12)13,3-20-8(14)15)4-21-9(16)17/h1-4H2

InChI key

TZRXHJWUDPFEEY-UHFFFAOYSA-N

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Legal Information

CERILLIANT is a registered trademark of Merck KGaA, Darmstadt, Germany
Snap-N-Shoot is a registered trademark of Cerilliant Corporation
Snap-N-Spike is a registered trademark of Merck KGaA, Darmstadt, Germany

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

35.6 °F - closed cup

Flash Point(C)

2 °C - closed cup

Regulatory Information

危险化学品
This item has

Certificates of Analysis (COA)

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[Therapy with pentaerithrityltetranitrate (PETN). Established effectiveness, once again on trial].
MMW Fortschritte der Medizin, 153(7), 44-45 (2011-06-09)
Michael L Hobbs et al.
The journal of physical chemistry. A, 114(16), 5306-5319 (2010-04-07)
Ignition experiments from various sources, including our own laboratory, have been used to develop a simple ignition model for pentaerythritol tetranitrate (PETN). The experiments consist of differential thermal analysis, thermogravimetric analysis, differential scanning calorimetry, beaker tests, one-dimensional time to explosion
Andrey Pereverzev et al.
The Journal of chemical physics, 134(1), 014513-014513 (2011-01-12)
Normal vibrational modes for a three-dimensional defect-free crystal of the high explosive pentaerythritol tetranitrate were obtained in the framework of classical mechanics using a previously published unreactive potential-energy surface [J. Phys. Chem. B 112, 734 (2008)]. Using these results the
Matthias Oelze et al.
Experimental diabetes research, 2010, 213176-213176 (2011-01-15)
Organic nitrates represent a class of drugs which are clinically used for treatment of ischemic symptoms of angina as well as for congestive heart failure based on the idea to overcome the impaired NO bioavailability by "NO" replacement therapy. The
John A S Smith et al.
Journal of magnetic resonance (San Diego, Calif. : 1997), 204(1), 139-144 (2010-03-20)
The explosive pentaerythritol tetranitrate (PETN) C(CH(2)-O-NO(2))(4) has been studied by (1)H NMR and (14)N NQR. The (14)N NQR frequency and spin-lattice relaxation time T(1Q) for the nu(+) line have been measured at temperatures from 255 to 325K. The (1)H NMR
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