CCO.CC1=CC=CC=C1.O
Название: ethanol;toluene;hydrate
SMILES: CCO.CC1=CC=CC=C1.O

Molecular Processing

Molecular formula
C9H16O2
Molecular weight
156.22
Exact mass
156.115
XLogP
1.17
TPSA
51.73
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
3
Fraction Csp3
0.333
Molar refractivity
47.55

Supplementary Information

InChIKey: BRMNIPUJQIHQIE-UHFFFAOYSA-N
Синонимы
EtOH toluene waterEtOH water toluenetoluene EtOH waterwater EtOH tolueneEtOH H2O toluenetoluene EtOH H2Otoluene EtOH-H2Oethanol toluene H2OEtOH Toluene H2Otoluene ethanol H2Oethanol toluene waterethanol water toluenetoluene ethanol watertoluene water ethanolwater ethanol toluenewater toluene ethanolSCHEMBL19136016BRMNIPUJQIHQIE-UHFFFAOYSA-N
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