CC1=CC=C(C=C1)S
CAS: 106-45-6
Nombre: 4-methylbenzenethiol
SMILES: CC1=CC=C(C=C1)S

Molecular Processing

Molecular formula
C7H8S
Molecular weight
124.21
Exact mass
124.0347
XLogP
2.28
TPSA
0
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
38.43

Supplementary Information

InChIKey: WLHCBQAPPJAULW-UHFFFAOYSA-N
Sinónimos
4-Methylbenzenethiolp-Thiocresol106-45-6p-Toluenethiol4-Methylthiophenol4-THIOCRESOLp-Tolyl mercaptan4-Toluenethiolp-Methylthiophenolp-Tolylthiolp-Mercaptotoluenep-Thiolcresolp-Methylbenzenethiol1-Mercapto-4-methylbenzenep-Methylphenyl mercaptan4-Methylphenyl mercaptanUSAF EK-5104-MethylphenylmercaptanToluene, 4-mercapto-DTXSID50481886L2WW9XYZONSC-2227NSC-229565DTXCID0028163RefChem:527014203-399-1Benzenethiol, 4-methyl-p-TolylthiophenolToluene-4-thiol4-Mercaptotoluene
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