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Home > Bromides > 1384951-76-1
1384951-76-1 | 5H-Pyrrolo[3,2-d]pyrimidine, 7-bromo-4-chloro-5-ethyl-
CAS No: 1384951-76-1 Catalog No: AG0019AN MDL No:
Product Description
Catalog Number:
AG0019AN
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 7-bromo-4-chloro-5-ethyl-
CAS Number:
1384951-76-1
Molecular Formula:
C8H7BrClN3
Molecular Weight:
260.5183
IUPAC Name:
7-bromo-4-chloro-5-ethylpyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C8H7BrClN3/c1-2-13-3-5(9)6-7(13)8(10)12-4-11-6/h3-4H,2H2,1H3
InChI Key:
ZOYWPWWYZRDIKY-UHFFFAOYSA-N
SMILES:
CCn1cc(c2c1c(Cl)ncn2)Br
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.951g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.519g/mol
Monoisotopic Mass:
258.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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