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1152475-50-7 | 5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-7-iodo-
CAS No: 1152475-50-7 Catalog No: AG000GI5 MDL No:MFCD12406130
Product Description
Catalog Number:
AG000GI5
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-7-iodo-
CAS Number:
1152475-50-7
Molecular Formula:
C6H3ClIN3
Molecular Weight:
279.4656
MDL Number:
MFCD12406130
IUPAC Name:
2-chloro-7-iodo-5H-pyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C6H3ClIN3/c7-6-10-2-4-5(11-6)3(8)1-9-4/h1-2,9H
InChI Key:
INKBZIDRWUSKPM-UHFFFAOYSA-N
SMILES:
Clc1ncc2c(n1)c(I)c[nH]2
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.906g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.465g/mol
Monoisotopic Mass:
278.906g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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