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Home > Nitro Compounds > 596-48-5
596-48-5 | Methanol, tris (p-nitrophenyl)-
CAS No: 596-48-5 Catalog No: AG00EZL2 MDL No:
Product Description
Catalog Number:
AG00EZL2
Chemical Name:
Methanol, tris (p-nitrophenyl)-
CAS Number:
596-48-5
IUPAC Name:
tris(4-nitrophenyl)methanol
InChI:
InChI=1S/C19H13N3O7/c23-19(13-1-7-16(8-2-13)20(24)25,14-3-9-17(10-4-14)21(26)27)15-5-11-18(12-6-15)22(28)29/h1-12,23H
InChI Key:
VITHLMCGSJCNMI-UHFFFAOYSA-N
NSC Number:
87329
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.075g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
395.327g/mol
Monoisotopic Mass:
395.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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