Home Other Building Blocks 1-Chlorophthalazine

1-Chlorophthalazine

CAS No.:
5784-45-2
Catalog Number:
AG003E8S
Molecular Formula:
C8H5ClN2
Molecular Weight:
164.5917
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$402
- +
5g
1 week
United States
$1766
- +
10g
1 week
United States
$2975
- +
Product Description
Catalog Number:
AG003E8S
Chemical Name:
1-Chlorophthalazine
CAS Number:
5784-45-2
Molecular Formula:
C8H5ClN2
Molecular Weight:
164.5917
MDL Number:
MFCD00024141
IUPAC Name:
1-chlorophthalazine
InChI:
InChI=1S/C8H5ClN2/c9-8-7-4-2-1-3-6(7)5-10-11-8/h1-5H
InChI Key:
UCOVESIAFFGEOR-UHFFFAOYSA-N
SMILES:
Clc1nncc2c1cccc2
NSC Number:
71104
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.592g/mol
Monoisotopic Mass:
164.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties