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114969-93-6

114969-93-6 | Pyrimidine, 5-methoxy-4-phenyl-

CAS No: 114969-93-6 Catalog No: AG000FIV MDL No:MFCD18417362

Product Description

Catalog Number:
AG000FIV
Chemical Name:
Pyrimidine, 5-methoxy-4-phenyl-
CAS Number:
114969-93-6
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD18417362
IUPAC Name:
5-methoxy-4-phenylpyrimidine
InChI:
InChI=1S/C11H10N2O/c1-14-10-7-12-8-13-11(10)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
TWJVKNYUCBTYRY-UHFFFAOYSA-N
SMILES:
COc1cncnc1c1ccccc1

Properties

Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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