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Name	4-Chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine	EINECS	N/A
CAS No.	876343-10-1	Density	2.284 g/cm³
PSA	41.57000	LogP	2.21590
Solubility	N/A	Melting Point	N/A
Formula	C₆H₃ClIN₃	Boiling Point	N/A
Molecular Weight	279.467	Flash Point	N/A
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	1H-Pyrrolo[2,3-d]pyrimidine,4-chloro-6-iodo- (9CI);4-Chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine;	Article Data	5

4-Chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine Specification

The CAS register number of 4-Chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine is 876343-10-1. It also can be called as 7H-Pyrrolo[2,3-d]pyrimidine,4-chloro-6-iodo- and the systematic name about this chemical is 4-chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine. The molecular formula about this chemical is C₆H₃ClIN₃and molecular weight is 279.47. It belongs to the Chiral Chemicals.

Physical properties about 4-Chloro-6-iodo-7H-pyrrolo[2,3-d]pyrimidine are: (1)ACD/LogP: 1.41; (2)ACD/LogD (pH 5.5): 1.41; (3)ACD/LogD (pH 7.4): 1.41; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)Polar Surface Area: 41.57Å²; (7)Index of Refraction: 1.804; (8)Molar Refractivity: 52.51 cm³; (9)Molar Volume: 122.3 cm³; (10)Polarizability: 20.81x10^-24cm³; (11)Surface Tension: 84 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2c([nH]c1I)ncnc2Cl
(2)InChI: InChI=1/C6H3ClIN3/c7-5-3-1-4(8)11-6(3)10-2-9-5/h1-2H,(H,9,10,11)
(3)InChIKey: DXPVKZYVQANEDW-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H3ClIN3/c7-5-3-1-4(8)11-6(3)10-2-9-5/h1-2H,(H,9,10,11)
(5)Std. InChIKey: DXPVKZYVQANEDW-UHFFFAOYSA-N

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