C=CCOC1=CC=C(C=C1)CS
CAS: 864156-93-4
Name: (4-prop-2-enoxyphenyl)methanethiol
SMILES: C=CCOC1=CC=C(C=C1)CS

Molecular Processing

Molecular formula
C10H12OS
Molecular weight
180.27
Exact mass
180.0609
XLogP
2.68
TPSA
9.23
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
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
0.2
Molar refractivity
54.82

Supplementary Information

InChIKey: ZZUPZSRZTWIEGJ-UHFFFAOYSA-N
Synonyme
[4-(prop-2-en-1-yloxy)phenyl]methanethiol864156-93-44-(2-PROPEN-1-YLOXY)-BENZENEMETHANETHIOL957227-68-8SCHEMBL4512907(4-Allyloxy-phenyl)-methanethiolZZUPZSRZTWIEGJ-UHFFFAOYSA-NEN300-1288109
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