methyl 6-methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Modify Date: 2025-08-28 14:17:30

methyl 6-methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate structure	Common Name	methyl 6-methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
	CAS Number	134074-33-2	Molecular Weight	307.32500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₃H₁₃N₃O₄S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	methyl 6-methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (en)5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(3-nitrophenyl)-2-thioxo-, methyl ester (en)

Molecular Formula	C₁₃H₁₃N₃O₄S
Molecular Weight	307.32500
Exact Mass	307.06300
PSA	128.27000
LogP	2.74140
InChIKey	WKXYLZFLLHRNCP-UHFFFAOYSA-N
SMILES	COC(=O)C1=C(C)NC(=S)NC1c1cccc([N+](=O)[O-])c1

3-Nitrobenzaldehyde

CAS#:99-61-6

Methyl acetoacetate

CAS#:105-45-3

thiourea

CAS#:17356-08-0

~94%

methyl 6-methyl...

CAS#:134074-33-2

Literature: Liu, Qingjian; Pan, Ning; Xu, Jiehua; Zhang, Wenwen; Kong, Fanpeng Synthetic Communications, 2013 , vol. 43, # 1 p. 139 - 146

Precursor 2
CAS#:99-61-6 3-Nitrobenzaldehyde CAS#:105-45-3 Methyl acetoacetate
DownStream 0

Names