CC1=C(C=CC(=C1)I)O
CAS: 60577-30-2
Name: 4-iodo-2-methylphenol
SMILES: CC1=C(C=CC(=C1)I)O

Molecular Processing

Molecular formula
C7H7IO
Molecular weight
234.04
Exact mass
233.9542
XLogP
2.31
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
45.56

Supplementary Information

InChIKey: WSBDSSKIWDFOBQ-UHFFFAOYSA-N
Synonyme
4-Iodo-2-methylphenolRefChem:524182628-288-960577-30-2Phenol, 4-iodo-2-methyl-4-Iodo-o-cresolMFCD000750924-iodo-2-methyl-phenol2-methyl-4-iodophenol4-iodo-2-cresol2-hydroxy-5-iodotoluenePhenol, 2-methyl-4-iodoSCHEMBL172779SCHEMBL2637439SCHEMBL57474284-Iodo-2-methylphenol, 97%DTXSID00209379AKOS005259802FI69953AC-33910AS-57472SY041794DB-053663CS-0130295D70129F240049InChI=1/C7H7IO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H
Quelle anzeigen →
An 38 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→