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1314916-25-0 | Pteridine, 2-chloro-5,6,7,8-tetrahydro-8-methyl-
CAS No: 1314916-25-0 Catalog No: AG000WAN MDL No:
Product Description
Catalog Number:
AG000WAN
Chemical Name:
Pteridine, 2-chloro-5,6,7,8-tetrahydro-8-methyl-
CAS Number:
1314916-25-0
Molecular Formula:
C7H9ClN4
Molecular Weight:
184.6262
IUPAC Name:
2-chloro-8-methyl-6,7-dihydro-5H-pteridine
InChI:
InChI=1S/C7H9ClN4/c1-12-3-2-9-5-4-10-7(8)11-6(5)12/h4,9H,2-3H2,1H3
InChI Key:
JAOCALWYCRAAPN-UHFFFAOYSA-N
SMILES:
CN1CCNc2c1nc(Cl)nc2
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.627g/mol
Monoisotopic Mass:
184.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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