이름: O-ethyl 5-chloro-3,3-dimethyl-5-phenylpentanethioate
SMILES:
CCOC(=S)CC(C)(C)CC(C1=CC=CC=C1)ClMolecular Processing
Molecular formula
C15H21ClOS
Molecular weight
284.85
Exact mass
284.1002
XLogP
5.14
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
82.28
Supplementary Information
InChIKey: XBZSNSXSCXURSK-UHFFFAOYSA-N
동의어
SCHEMBL10811860XBZSNSXSCXURSK-UHFFFAOYSA-Nethyl 5-chloro-3,3-dimethyl-5-phenylthiopentanoateethyl 5-chloro-3,3-dimethyl-5-phenylthio-pentanoate
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