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138274-14-3 | Pyrimidine, 2-chloro-5-(phenylmethoxy)-
CAS No: 138274-14-3 Catalog No: AG0018FJ MDL No:MFCD09744017
Product Description
Catalog Number:
AG0018FJ
Chemical Name:
Pyrimidine, 2-chloro-5-(phenylmethoxy)-
CAS Number:
138274-14-3
Molecular Formula:
C11H9ClN2O
Molecular Weight:
220.6550
MDL Number:
MFCD09744017
IUPAC Name:
2-chloro-5-phenylmethoxypyrimidine
InChI:
InChI=1S/C11H9ClN2O/c12-11-13-6-10(7-14-11)15-8-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
XOCCSJLRSSDCLM-UHFFFAOYSA-N
SMILES:
Clc1ncc(cn1)OCc1ccccc1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.656g/mol
Monoisotopic Mass:
220.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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