Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate supplier

Name
ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
EINECS
CAS No. 144927-57-1
Article Data3
CAS DataBase
Density 1.459 g/cm³
Solubility
Melting Point 140-141 °C
Formula C₉H₈ClN₃O₂
Boiling Point 397.056 °C at 760 mmHg
Molecular Weight 225.634
Flash Point 193.933 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Pyrrolo[2,3-d]pyrimidine-5-carboxylicacid, 4-chloro-, ethyl ester (9CI);
PSA 67.87000
LogP 1.78800

Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate Specification

Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate , with the CAS register number 144927-57-1 has the systematic name of ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate . It is also be known to us as the 7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid,4-chloro-,ethyl ester and MFCD11518913 .

The Characteristics of this kind of chemical: (1)ACD/LogP: 1.82 ; (2)ACD/LogD (pH 5.5): 1 ; (3)ACD/LogD (pH 7.4): 1 ; (4)ACD/BCF (pH 5.5): 6 ; (5) ACD/BCF (pH 7.4): 6 ; (6)ACD/KOC (pH 5.5): 122 ; (7)ACD/KOC (pH 7.4): 121 ; (8)#H bond acceptors: 5 ; (9)#H bond donors: 1 ; (10)#Freely Rotating Bonds: 3 ; (11)Polar Surface Area: 67.87 ; (12)Index of Refraction: 1.644 ; (13)Molar Refractivity: 56.012 cm³ ; (14)Molar Volume: 154.669 cm³ ; (15)Polarizability: 22.205 ×10-24cm³ ; (16)Surface Tension: 65.201 dyne/cm ; (17)Density: 1.459 g/cm³ ; (18)Flash Point: 193.933 °C ; (19)Enthalpy of Vaporization: 64.744 kJ/mol ; (20)Boiling Point: 397.056 °C at 760 mmHg .

This kind of chemical belongs to the product categories of CHIRAL CHEMICALS, and it is usually used in the chemistry and pharmaceutics. In addition, you could also refer the following data information to obtain the molecular structure:
SMILES: Clc1ncnc2c1c(cn2)C(=O)OCC
InChI: InChI=1/C9H8ClN3O2/c1-2-15-9(14)5-3-11-8-6(5)7(10)12-4-13-8/h3-4H,2H2,1H3,(H,11,12,13)
InChIKey: PCLIRPRTLSCXET-UHFFFAOYAY

As for the market information, it has many suppliers such as BePharm,Ltd. which provide this chemical with the packing of 1g;10g;100g;1kg;10kg. And there are other suppliers, such as Shangchem Co., Ltd.

Product Name

ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate Specification

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