ChemicalBook >> CAS DataBase List >>4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester

CAS No.
1053656-57-7
Chemical Name:
4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester
Synonyms
tert-Butyl 4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H);tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate;Tert-butyl 4-chloro-6,8-dihydro-5h-pyrido[3,4-d]pyrimidine-7-carboxylat;tert-butyl 4-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate;4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester;Pyrido[3,4-d]pyrimidine-7(6H)-carboxylic acid, 4-chloro-5,8-dihydro-, 1,1-dimethylethyl ester
CBNumber:
CB52663866
Molecular Formula:
C12H16ClN3O2
Molecular Weight:
269.73
MDL Number:
MFCD11109465
MOL File:
1053656-57-7.mol
Last updated:2025-10-14 17:28:51
Product description Number Pack Size Price
tert-Butyl4-Chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate B811120 10mg $45
tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate 4H51-5-04 250mg $265
tert-Butyl 4-chloro-5,6-dihydropyrido-[3,4-d]pyrimidine-7(8H)-carboxylate 95+% 073178 250mg $370
tert-Butyl4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate X8758 1g $518
tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate 4H51-5-04 1g $825
More product size

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester Properties

Boiling point 395.8±42.0 °C(Predicted)
Density 1.266±0.06 g/cm3(Predicted)
storage temp. -20°C, sealed storage, away from moisture
pka -0.04±0.20(Predicted)
Appearance White to off-white Solid
InChI InChI=1S/C12H16ClN3O2/c1-12(2,3)18-11(17)16-5-4-8-9(6-16)14-7-15-10(8)13/h7H,4-6H2,1-3H3
InChIKey XYHXUYOSXZHUSZ-UHFFFAOYSA-N
SMILES C1=NC(Cl)=C2CCN(C(OC(C)(C)C)=O)CC2=N1

SAFETY

Risk and Safety Statements

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester price More Price(16)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TRC B811120 tert-Butyl4-Chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate 1053656-57-7 10mg $45 2021-12-16 Buy
SynQuest Laboratories 4H51-5-04 tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate 1053656-57-7 250mg $265 2021-12-16 Buy
Matrix Scientific 073178 tert-Butyl 4-chloro-5,6-dihydropyrido-[3,4-d]pyrimidine-7(8H)-carboxylate 95+% 1053656-57-7 250mg $370 2021-12-16 Buy
AK Scientific X8758 tert-Butyl4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate 1053656-57-7 1g $518 2021-12-16 Buy
SynQuest Laboratories 4H51-5-04 tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate 1053656-57-7 1g $825 2021-12-16 Buy
Product number Packaging Price Buy
B811120 10mg $45 Buy
4H51-5-04 250mg $265 Buy
073178 250mg $370 Buy
X8758 1g $518 Buy
4H51-5-04 1g $825 Buy

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester Chemical Properties,Uses,Production

Synthesis

tert-butyl 4-oxo-3,4,5,6-tetrahydropyrido[3,4-d]pyriMidine-7(8H)-carboxylate

1142188-60-0

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester

1053656-57-7

General procedure for the synthesis of tert-butyl 4-chloro-5,8-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate from tert-butyl 4-hydroxy-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate: to a solution of intermediate 1 (1.26 g, 5.02 mmol) in ethylene dichloride (DCE, 36 mL), sequentially added triphenylphosphine (PPh3, 2.69 g, 10.05 mmol) and carbon tetrachloride (CCl4, 1.46 mL, 15.07 mmol). The reaction mixture was heated to 70 °C and maintained for 2.5 hours. After completion of the reaction, the mixture was concentrated under reduced pressure and purified by silica gel (SiO2) column chromatography with ethyl acetate/hexane as eluent to afford the target compound as a light yellow solid (1.20 g, 88% yield). The mass spectrometry (ESI) calculated value of C12H16ClN3O2 was 269.09, and the measured value m/z 270.1 [M + H]+.1H NMR (400 MHz, CDCl3) δ: 8.79 (s, 1H), 4.65 (br s, 2H), 3.80-3.68 (m, 2H), 2.93-2.82 (m, 2H), 1.49 ( s, 9H).

References

[1] Patent: US2014/275120, 2014, A1. Location in patent: Paragraph 0160; 0161
[2] Patent: WO2011/29842, 2011, A1. Location in patent: Page/Page column 40-41
[3] ACS Medicinal Chemistry Letters, 2013, vol. 4, # 2, p. 186 - 190
[4] Patent: US2016/75708, 2016, A1. Location in patent: Paragraph 0086; 0092
[5] Patent: KR2015/139962, 2015, A. Location in patent: Paragraph 0118-0119; 0131-0132

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester Preparation Products And Raw materials

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4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester pictures 2021-07-13 4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester
1053656-57-7
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd
4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester pictures 2021-07-10 4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester
1053656-57-7
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd
tert-Butyl 4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate pictures 2020-02-09 tert-Butyl 4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
1053656-57-7
US $1.00 / GK 1g Min98% HPLC g/kg/ton Career Henan Chemical Co

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester Spectrum

1053656-57-7(4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester)Related Search:

4-chloro-5,8-dihydro-6H-pyrido[3,4-d]pyriMidine-7-carboxylic acid tert-butyl ester tert-Butyl 4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H) tert-butyl 4-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate tert-Butyl 4-chloro-5H,6H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate Pyrido[3,4-d]pyrimidine-7(6H)-carboxylic acid, 4-chloro-5,8-dihydro-, 1,1-dimethylethyl ester Tert-butyl 4-chloro-6,8-dihydro-5h-pyrido[3,4-d]pyrimidine-7-carboxylat 1053656-57-7