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10132-01-1 | Phthalazine, 1-chloro-4-phenyl-
CAS No: 10132-01-1 Catalog No: AG000489 MDL No:MFCD00524786
Product Description
Catalog Number:
AG000489
Chemical Name:
Phthalazine, 1-chloro-4-phenyl-
CAS Number:
10132-01-1
Molecular Formula:
C14H9ClN2
Molecular Weight:
240.6877
MDL Number:
MFCD00524786
IUPAC Name:
1-chloro-4-phenylphthalazine
InChI:
InChI=1S/C14H9ClN2/c15-14-12-9-5-4-8-11(12)13(16-17-14)10-6-2-1-3-7-10/h1-9H
InChI Key:
WJJDLSHYLZRFDD-UHFFFAOYSA-N
SMILES:
Clc1nnc(c2c1cccc2)c1ccccc1
NSC Number:
116340
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.045g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.69g/mol
Monoisotopic Mass:
240.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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