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Home Other Building Blocks 2-(4,6-dimethyl-2-oxo-1,2-dihydropyrimidin-1-yl)acetic acid hydrochloride

2-(4,6-dimethyl-2-oxo-1,2-dihydropyrimidin-1-yl)acetic acid hydrochloride

CAS No.:
1179377-17-3
Catalog Number:
AG01AC0G
Molecular Formula:
C8H11ClN2O3
Molecular Weight:
218.6375
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Product Description
Catalog Number:
AG01AC0G
Chemical Name:
2-(4,6-dimethyl-2-oxo-1,2-dihydropyrimidin-1-yl)acetic acid hydrochloride
CAS Number:
1179377-17-3
Molecular Formula:
C8H11ClN2O3
Molecular Weight:
218.6375
MDL Number:
MFCD00456856
IUPAC Name:
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C8H10N2O3.ClH/c1-5-3-6(2)10(4-7(11)12)8(13)9-5;/h3H,4H2,1-2H3,(H,11,12);1H
InChI Key:
RBQZRNSVTXATNR-UHFFFAOYSA-N
SMILES:
Cc1cc(C)nc(=O)n1CC(=O)O.Cl
Properties
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.637g/mol
Monoisotopic Mass:
218.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties