CCC1=CC(=CC=C1)O
CAS: 620-17-7
Name: 3-ethylphenol
SMILES: CCC1=CC(=CC=C1)O

Molecular Processing

Molecular formula
C8H10O
Molecular weight
122.17
Exact mass
122.0732
XLogP
1.95
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
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
0.25
Molar refractivity
37.48

Supplementary Information

InChIKey: HMNKTRSOROOSPP-UHFFFAOYSA-N
Synonyme
3-ETHYLPHENOL620-17-7Phenol, 3-ethyl-Phenol, m-ethyl-meta-Ethylphenol1-Ethyl-3-hydroxybenzeneBenzene, 1-ethyl-3-hydroxy-DTXSID00224800G9ZK222JXNSC-8873DTXCID402480RefChem:93864210-627-3m-Ethylphenol1-Hydroxy-3-ethylbenzene3-Ethyl-phenolMFCD000023113-Ethylphenol 100 microg/mL in MethanolCAS-620-17-7HSDB 57203-ETHYL PHENOLNSC 8873EINECS 210-627-3UNII-0G9ZK222JXAI3-19938m-Ethyl phenol3-Ethylphenol (NIST)ETHYLPHENOL, 3-SCHEMBL517573-ETHYLPHENOL [HSDB]
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