Home Halogens 1-Phthalazinamine,4-chloro-

1-Phthalazinamine,4-chloro-

CAS No.:
13580-86-4
Catalog Number:
AG007N65
Molecular Formula:
C8H6ClN3
Molecular Weight:
179.6063
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Product Description
Catalog Number:
AG007N65
Chemical Name:
1-Phthalazinamine,4-chloro-
CAS Number:
13580-86-4
Molecular Formula:
C8H6ClN3
Molecular Weight:
179.6063
IUPAC Name:
4-chlorophthalazin-1-amine
InChI:
InChI=1S/C8H6ClN3/c9-7-5-3-1-2-4-6(5)8(10)12-11-7/h1-4H,(H2,10,12)
InChI Key:
IJYLJLPFNAQRLL-UHFFFAOYSA-N
SMILES:
Clc1nnc(c2c1cccc2)N
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.025g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.607g/mol
Monoisotopic Mass:
179.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties