C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)I
Name: 2-(4-iodophenyl)-1,3-benzoxazole
SMILES: C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)I

Molecular Processing

Molecular formula
C13H8INO
Molecular weight
321.12
Exact mass
320.9651
XLogP
4.1
TPSA
26.03
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
72.16

Supplementary Information

InChIKey: GLRVAFAIWYHTEZ-UHFFFAOYSA-N
Synonyme
2-(4-iodophenyl)-1,3-benzoxazole2-(4-iodophenyl)benzoxazoleCBDivE_014900SCHEMBL308672GLRVAFAIWYHTEZ-UHFFFAOYSA-NAKOS000472929
Quelle anzeigen →
An 10 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→