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85030-38-2 | 4-[(4-AMINO-2-CHLOROPHENYL)AZO]NAPHTHALEN-1-AMINE
CAS No: 85030-38-2 Catalog No: AG004PYA MDL No:
Product Description
Catalog Number:
AG004PYA
Chemical Name:
4-[(4-AMINO-2-CHLOROPHENYL)AZO]NAPHTHALEN-1-AMINE
CAS Number:
85030-38-2
Molecular Formula:
C16H13ClN4
Molecular Weight:
296.7542
IUPAC Name:
4-[(4-amino-2-chlorophenyl)diazenyl]naphthalen-1-amine
InChI:
InChI=1S/C16H13ClN4/c17-13-9-10(18)5-7-16(13)21-20-15-8-6-14(19)11-3-1-2-4-12(11)15/h1-9H,18-19H2
InChI Key:
RSOCDNOXQMQKJV-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Cl)N=Nc1ccc(c2c1cccc2)N
EC Number:
285-162-2
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.083g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.758g/mol
Monoisotopic Mass:
296.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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