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Merck
CN

311022

Di(2-pyridyl) thionocarbonate

98%

Synonym(s):

Di-2-pyridyl thionocarbonate, O,O-Di(2-pyridinyl) thiocarbonate, O,O-Di(pyridin-2-yl) carbonothioate, O,O′-Di(pyridin-2-yl) carbonothioate, Thiocarbonic acid di-O,O-(2-pyridyl) ester

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About This Item

Empirical Formula (Hill Notation):
C11H8N2O2S
CAS Number:
96989-50-3
Molecular Weight:
232.26
Beilstein:
4314435
MDL number:
MFCD00074870
UNSPSC Code:
12352100
PubChem Substance ID:
24858831
NACRES:
NA.22

Key Documents

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Quality Level

100

Assay

98%

mp

94-98 °C (lit.)

storage temp.

−20°C

SMILES string

S=C(Oc1ccccn1)Oc2ccccn2

InChI

1S/C11H8N2O2S/c16-11(14-9-5-1-3-7-12-9)15-10-6-2-4-8-13-10/h1-8H

InChI key

IKYOVSVBLHGFMA-UHFFFAOYSA-N

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Application

Di-2-pyridyl thionocarbonate (DPT) was used in the synthesis of 10-des(carbamoyloxy)-10-isothiocyanatoporfiromycin. It was also used as a substitute of thiophosgene, a highly toxic agent, in the preparation of isothiocyanate.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKBX2639V
MKBL5765V
MKBH1058V
MKBD1779V
MKBD1779

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N Huh et al.
Bioconjugate chemistry, 7(6), 659-669 (1996-11-01)
Mitomycin C (1) is the prototypical bioreductive alkylating agent. Studies have shown that mitomycin C and its derivatives selectively alkylate guanine residues within di- and trinucleotide DNA sequences. This investigation sought to improve the selective DNA bonding properties of the
Mariarita Barone et al.
Molecular diversity, 17(3), 445-458 (2013-04-27)
The aim of this work was to evaluate the potential anti-inflammatory activity of eleven (5-15) new synthesized derivatives of benzo-thieno[3,2-d]pyrimidine on two cell models, namely human keratinocytes NCTC 2544 and mouse monocyte-macrophages J774. For the synthesis of test compounds an

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