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181363-06-4 | Pyrimidine, 4-(bromomethyl)-2-chloro-
CAS No: 181363-06-4 Catalog No: AG0022UC MDL No:MFCD11052620
Product Description
Catalog Number:
AG0022UC
Chemical Name:
Pyrimidine, 4-(bromomethyl)-2-chloro-
CAS Number:
181363-06-4
Molecular Formula:
C5H4BrClN2
Molecular Weight:
207.4557
MDL Number:
MFCD11052620
IUPAC Name:
4-(bromomethyl)-2-chloropyrimidine
InChI:
InChI=1S/C5H4BrClN2/c6-3-4-1-2-8-5(7)9-4/h1-2H,3H2
InChI Key:
FONRFIJJNODTBH-UHFFFAOYSA-N
SMILES:
BrCc1ccnc(n1)Cl
Properties
Complexity:
91
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.925g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.455g/mol
Monoisotopic Mass:
205.925g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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