CC(C)C1=CC=C(C=C1)C2=NC(=CS2)CCl
CAS: 668476-91-3
الاسم: 4-(chloromethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole
SMILES: CC(C)C1=CC=C(C=C1)C2=NC(=CS2)CCl

Molecular Processing

Molecular formula
C13H14ClNS
Molecular weight
251.78
Exact mass
251.0535
XLogP
4.67
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
71.2

Supplementary Information

InChIKey: XIAVGPVZWJKADE-UHFFFAOYSA-N
مرادفات
668476-91-3SCHEMBL3372678XIAVGPVZWJKADE-UHFFFAOYSA-NAKOS000122890DB-0876864-chloromethyl-2-(4-isopropyl-phenyl)-thiazole
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