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Merck
CN

34333

Dinitramine

PESTANAL®, analytical standard

Synonym(s):

3-Diethylamino-2,4-dinitro-6-trifluoromethylaniline

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About This Item

Empirical Formula (Hill Notation):
C11H13F3N4O4
CAS Number:
29091-05-2
Molecular Weight:
322.24
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
329754949
EC Number:
249-419-2
Beilstein/REAXYS Number:
2822138
MDL number:
MFCD00144149

Key Documents

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InChI

1S/C11H13F3N4O4/c1-3-16(4-2)9-7(17(19)20)5-6(11(12,13)14)8(15)10(9)18(21)22/h5H,3-4,15H2,1-2H3

InChI key

OFDYMSKSGFSLLM-UHFFFAOYSA-N

SMILES string

CCN(CC)c1c(cc(c(N)c1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O

grade

analytical standard

product line

PESTANAL®

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

application(s)

agriculture
environmental

format

neat

Quality Level

100

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Application

Dinitramine may be used as an analytical reference standard for the determination of the analyte in freshwater fish, soil and plant tissue, honey, fruit juice and wine, and food matrices by various chromatography techniques.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

pictograms

Exclamation markEnvironment
GHS07,GHS09

signalword

Warning

hcodes

H312,H400

Hazard Classifications

Acute Tox. 4 Dermal - Aquatic Acute 1

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

农药列管产品
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Certificates of Analysis (COA)

Lot/Batch Number
BCCK7867
BCCD4846
BCCB4843
BCBX4541

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Dinitramine. Residues in and toxicity to freshwater fish.
Olson LE, et al.
Journal of Agricultural and Food Chemistry, 23(3), 437-439 (1975)
Determination of dinitramine residues in soil and plant tissue.
Newsom HC and Mitchell EM
Journal of Agricultural and Food Chemistry, 20(6), 1222-1224 (1972)
Persistence of dinitramine and trifluralin in Nova Scotia, Canada.
K I Jensen et al.
Bulletin of environmental contamination and toxicology, 24(2), 238-243 (1980-02-01)
Annamaria Halasz et al.
Environmental science & technology, 36(4), 633-638 (2002-03-07)
In an earlier study, we reported that hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) biodegraded with domestic anaerobic sludge to produce a key RDX ring cleavage intermediate that was tentatively identified as methylenedinitramine (O2NNHCH2NHNO2) using LC/MS with negative electrospray ionization (ES-). Recently, we obtained a
Bharat Bhushan et al.
Biochemical and biophysical research communications, 306(2), 509-515 (2003-06-14)
Enzyme catalyzed biotransformation of the energetic chemical octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) is not known. The present study describes a xanthine oxidase (XO) catalyzed biotransformation of HMX to provide insight into the biodegradation pathway of this energetic chemical. The rates of biotransformation under
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