Home Halogens 4-chloro-5,6,7,8-tetrahydropteridin-6-one hydrochloride

4-chloro-5,6,7,8-tetrahydropteridin-6-one hydrochloride

CAS No.:
1955539-81-7
Catalog Number:
AG01B5BQ
Molecular Formula:
C6H6Cl2N4O
Molecular Weight:
221.0440
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Product Description
Catalog Number:
AG01B5BQ
Chemical Name:
4-chloro-5,6,7,8-tetrahydropteridin-6-one hydrochloride
CAS Number:
1955539-81-7
Molecular Formula:
C6H6Cl2N4O
Molecular Weight:
221.0440
MDL Number:
MFCD29991998
IUPAC Name:
4-chloro-7,8-dihydro-5H-pteridin-6-one;hydrochloride
InChI:
InChI=1S/C6H5ClN4O.ClH/c7-5-4-6(10-2-9-5)8-1-3(12)11-4;/h2H,1H2,(H,11,12)(H,8,9,10);1H
InChI Key:
LTYPRIZGNBUSCQ-UHFFFAOYSA-N
SMILES:
O=C1CNc2c(N1)c(Cl)ncn2.Cl
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.992g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
221.041g/mol
Monoisotopic Mass:
219.992g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties