CAS
3682-15-3 Purity
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3682-15-3 Purity
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6-Phenyl-2-thiouracil
CAS
36822-11-4
Catalog Number
ACM36822114
Category
Other Products
Molecular Weight
204.25
Molecular Formula
C10H8N2OS
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Specification
Synonyms
Phenylthiouracil, 6-Phenylthiouracil, 6-Phenyl-2-thiouracil, nchembio.63-comp2, ChemDiv3_000344, CBChromo1_000231, CBDivE_012254, P3252_SIGMA, NSC42600, BB_SC-1406, 6-phenyl-2-sulfanyl-4-pyrimidinol, 2-Mercapto-4-phenyl-6-pyrimidinol, EINECS 253-227-4, NSC 42600, NSC163991, ZINC00281402, ZINC05072874, 6-Pyrimidinol, 2-mercapto-4-phenyl-, NSC 163991, IDI1_019662
IUPAC Name
6-phenyl-2-sulfanylidene-1H-pyrimidin-4-one
Canonical SMILES
C1=CC=C(C=C1)C2=CC(=O)NC(=S)N2
InChI Key
XEKNACRTWJHOCE-UHFFFAOYSA-N
Boiling Point
462.3ºC at 760 mmHg
Flash Point
233.4ºC
Density
1.37 g/cm³
EC Number
253-227-4
Exact Mass
204.03600
H-Bond Acceptor
1
H-Bond Donor
2
WGK Germany
3
Upstream Synthesis Route 1
- 94-02-0
- 17356-08-0
- 36822-11-4
Reference: [1] Zeitschrift fur Naturforschung - Section B Journal of Chemical Sciences, 1999, vol. 54, # 6, p. 788 - 798
Upstream Synthesis Route 2
- 73921-19-4
- 17356-08-0
- 36822-11-4
Reference: [1] Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2011, vol. 50, # 5, p. 745 - 747
Upstream Synthesis Route 3
- 1147550-11-5
- 94-02-0
- 36822-11-4
Reference: [1] Journal fuer Praktische Chemie (Leipzig), 1893, vol. <2> 47, p. 203
Downstream Synthesis Route 1
- 36822-11-4
- 74-88-4
- 56035-29-1
Reference: [1]Zhurnal Obshchei Khimii,1951,vol. 21,p. 760,762;engl.Ausg.S.837,839
Downstream Synthesis Route 2
- 36822-11-4
- 99072-62-5
Reference: [1]Journal of the American Chemical Society,1956,vol. 78,p. 3696
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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