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

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

CAS No.:
1707394-13-5
Catalog Number:
AG01A4V8
Molecular Formula:
C7H7ClN4O
Molecular Weight:
198.6097
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Product Description
Catalog Number:
AG01A4V8
Chemical Name:
4-chloro-8-methyl-5,6,7,8-tetrahydropteridin-6-one
CAS Number:
1707394-13-5
Molecular Formula:
C7H7ClN4O
Molecular Weight:
198.6097
MDL Number:
MFCD27981091
IUPAC Name:
4-chloro-8-methyl-5,7-dihydropteridin-6-one
InChI:
InChI=1S/C7H7ClN4O/c1-12-2-4(13)11-5-6(8)9-3-10-7(5)12/h3H,2H2,1H3,(H,11,13)
InChI Key:
GTGYLCJIIGSJPX-UHFFFAOYSA-N
SMILES:
O=C1CN(C)c2c(N1)c(Cl)ncn2
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.031g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.61g/mol
Monoisotopic Mass:
198.031g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties