C1=CC=C2C(=C1)N=CS2
CAS: 95-16-9
Nombre: 1,3-benzothiazole
SMILES: C1=CC=C2C(=C1)N=CS2

Molecular Processing

Molecular formula
C7H5NS
Molecular weight
135.19
Exact mass
135.0143
XLogP
2.3
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.62

Supplementary Information

InChIKey: IOJUPLGTWVMSFF-UHFFFAOYSA-N
Sinónimos
BENZOTHIAZOLE95-16-91,3-BenzothiazoleBenzosulfonazole1-Thia-3-azaindeneVangard BTUSAF EK-4812FEMA No. 3256FEMA Number 3256DTXSID7024586O-2857CHEBI:45993G5BW2593EPNSC-8040DTXCID204586RefChem:118563202-396-2BENZO[D]THIAZOLEbenzothiazolMFCD00005775BTbenzthiazoleCAS-95-16-9CCRIS 7893HSDB 2796NSC 8040EINECS 202-396-2BRN 0109468UNII-G5BW2593EPs-benzothiazole
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