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25977-69-9 | 1-Triazene, 1-(4-chlorophenyl)-3-(4-methylphenyl)- (9CI)
CAS No: 25977-69-9 Catalog No: AG002R97 MDL No:
Product Description
Catalog Number:
AG002R97
Chemical Name:
1-Triazene, 1-(4-chlorophenyl)-3-(4-methylphenyl)- (9CI)
CAS Number:
25977-69-9
Molecular Formula:
C13H12ClN3
Molecular Weight:
245.7075
IUPAC Name:
4-chloro-N-[(4-methylphenyl)diazenyl]aniline
InChI:
InChI=1S/C13H12ClN3/c1-10-2-6-12(7-3-10)15-17-16-13-8-4-11(14)5-9-13/h2-9H,1H3,(H,15,16)
InChI Key:
ITZWPIVVJKJCHB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NN=Nc1ccc(cc1)Cl
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.71g/mol
Monoisotopic Mass:
245.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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