Home Halogens 6-bromouracil

6-bromouracil

CAS No.:
4269-93-6
Catalog Number:
AG00CRIK
Molecular Formula:
C4H3BrN2O2
Molecular Weight:
190.9828
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Product Description
Catalog Number:
AG00CRIK
Chemical Name:
6-bromouracil
CAS Number:
4269-93-6
Molecular Formula:
C4H3BrN2O2
Molecular Weight:
190.9828
MDL Number:
MFCD20728060
IUPAC Name:
6-bromo-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C4H3BrN2O2/c5-2-1-3(8)7-4(9)6-2/h1H,(H2,6,7,8,9)
InChI Key:
YQJUVVITEPKZTL-UHFFFAOYSA-N
SMILES:
Brc1cc(=O)[nH]c(=O)[nH]1
NSC Number:
404760
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.938g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.984g/mol
Monoisotopic Mass:
189.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties