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4319-87-3 | 5-Bromo-4-methoxy-6-methylpyrimidine
CAS No: 4319-87-3 Catalog No: AG003MJG MDL No:MFCD19382397
Product Description
Catalog Number:
AG003MJG
Chemical Name:
5-Bromo-4-methoxy-6-methylpyrimidine
CAS Number:
4319-87-3
Molecular Formula:
C6H7BrN2O
Molecular Weight:
203.0366
MDL Number:
MFCD19382397
IUPAC Name:
5-bromo-4-methoxy-6-methylpyrimidine
InChI:
InChI=1S/C6H7BrN2O/c1-4-5(7)6(10-2)9-3-8-4/h3H,1-2H3
InChI Key:
YDPPNMNAHGZFDJ-UHFFFAOYSA-N
SMILES:
COc1ncnc(c1Br)C
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.974g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.039g/mol
Monoisotopic Mass:
201.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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