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143945-72-6 | 1H-Tetrazole, 5-(2-bromophenyl)-1-(triphenylmethyl)-
CAS No: 143945-72-6 Catalog No: AG001IMU MDL No:MFCD09263643
Product Description
Catalog Number:
AG001IMU
Chemical Name:
1H-Tetrazole, 5-(2-bromophenyl)-1-(triphenylmethyl)-
CAS Number:
143945-72-6
Molecular Formula:
C26H19BrN4
Molecular Weight:
467.3599
MDL Number:
MFCD09263643
IUPAC Name:
5-(2-bromophenyl)-1-trityltetrazole
InChI:
InChI=1S/C26H19BrN4/c27-24-19-11-10-18-23(24)25-28-29-30-31(25)26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19H
InChI Key:
KHMJZQFKDOBODS-UHFFFAOYSA-N
SMILES:
Brc1ccccc1c1nnnn1C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
508
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
466.079g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
467.37g/mol
Monoisotopic Mass:
466.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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