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19064-74-5 | Phthalazine, 6-bromo-
CAS No: 19064-74-5 Catalog No: AG002EOQ MDL No:MFCD08706238
Product Description
Catalog Number:
AG002EOQ
Chemical Name:
Phthalazine, 6-bromo-
CAS Number:
19064-74-5
Molecular Formula:
C8H5BrN2
Molecular Weight:
209.0427
MDL Number:
MFCD08706238
IUPAC Name:
6-bromophthalazine
InChI:
InChI=1S/C8H5BrN2/c9-8-2-1-6-4-10-11-5-7(6)3-8/h1-5H
InChI Key:
PEXFBIQTIZNHNP-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)cnnc2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.964g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.046g/mol
Monoisotopic Mass:
207.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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