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Tris(4-nitrophenyl)amine

Catalog Number
ACM20440931
Product Name
Tris(4-nitrophenyl)amine
Structure
CAS
20440-93-1
Category
Small Molecule Semiconductor Building Blocks
IUPAC Name
4-nitro-N,N-bis(4-nitrophenyl)aniline
Molecular Weight
380.3g/mol
Molecular Formula
C18H12N4O6
Canonical SMILES
C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C18H12N4O6/c23-20(24)16-7-1-13(2-8-16)19(14-3-9-17(10-4-14)21(25)26)15-5-11-18(12-6-15)22(27)28/h1-12H
InChI Key
LSNJBIDKQIRWRQ-UHFFFAOYSA-N
Complexity
481
Covalently-Bonded Unit Count
1
Exact Mass
380.075684g/mol
Formal Charge
0
Heavy Atom Count
28
Monoisotopic Mass
380.075684g/mol
Rotatable Bond Count
3
XLogP3
4.6
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