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1086382-15-1 | 4-bromo-6-cyclobutylpyrimidine
CAS No: 1086382-15-1 Catalog No: AG01FMLY MDL No:MFCD11223264
Product Description
Catalog Number:
AG01FMLY
Chemical Name:
4-bromo-6-cyclobutylpyrimidine
CAS Number:
1086382-15-1
Molecular Formula:
C8H9BrN2
Molecular Weight:
213.0745
MDL Number:
MFCD11223264
IUPAC Name:
4-bromo-6-cyclobutylpyrimidine
InChI:
InChI=1S/C8H9BrN2/c9-8-4-7(10-5-11-8)6-2-1-3-6/h4-6H,1-3H2
InChI Key:
UNRFBJIDVXIJOL-UHFFFAOYSA-N
SMILES:
Brc1ncnc(c1)C1CCC1
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.995g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.078g/mol
Monoisotopic Mass:
211.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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