Home Halogens 1-[(3-bromophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

1-[(3-bromophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:
313376-81-7
Catalog Number:
AG01A2VB
Molecular Formula:
C11H9BrN2O2
Molecular Weight:
281.1054
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Product Description
Catalog Number:
AG01A2VB
Chemical Name:
1-[(3-bromophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CAS Number:
313376-81-7
Molecular Formula:
C11H9BrN2O2
Molecular Weight:
281.1054
MDL Number:
MFCD00836294
IUPAC Name:
1-[(3-bromophenyl)methyl]pyrimidine-2,4-dione
InChI:
InChI=1S/C11H9BrN2O2/c12-9-3-1-2-8(6-9)7-14-5-4-10(15)13-11(14)16/h1-6H,7H2,(H,13,15,16)
InChI Key:
BTODMHTXMMIULV-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)Cn1ccc(=O)[nH]c1=O
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.985g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.109g/mol
Monoisotopic Mass:
279.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties