이름: 2-tert-butyl-5-nitrobenzene-1-sulfonyl chloride
SMILES:
CC(C)(C)c1ccc([N+](=O)[O-])cc1S(=O)(=O)ClMolecular Processing
Molecular formula
C10H12ClNO4S
Molecular weight
277.73
Exact mass
277.0176
XLogP
2.82
TPSA
77.28
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
64.84
Supplementary Information
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