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202823-67-4 | 5,8-Ethanophthalazine, 1,4-dichloro-5,6,7,8-tetrahydro-
CAS No: 202823-67-4 Catalog No: AG0028G5 MDL No:MFCD01075667
Product Description
Catalog Number:
AG0028G5
Chemical Name:
5,8-Ethanophthalazine, 1,4-dichloro-5,6,7,8-tetrahydro-
CAS Number:
202823-67-4
Molecular Formula:
C10H10Cl2N2
Molecular Weight:
229.1058
MDL Number:
MFCD01075667
IUPAC Name:
3,6-dichloro-4,5-diazatricyclo[6.2.2.02,7]dodeca-2(7),3,5-triene
InChI:
InChI=1S/C10H10Cl2N2/c11-9-7-5-1-2-6(4-3-5)8(7)10(12)14-13-9/h5-6H,1-4H2
InChI Key:
GZIFYLGNTOAIJJ-UHFFFAOYSA-N
SMILES:
Clc1nnc(c2c1C1CCC2CC1)Cl
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.022g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.104g/mol
Monoisotopic Mass:
228.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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