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2-Aminobenzothiazole

CAT: 0024-sc-251695Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-251695Size:5 g
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CAS Number
136-95-8

Chemical Information

Benzo(d)thiazol-2-amine

2-aminobenzothiazole is a member of benzothiazoles.

CAS Number136-95-8
PubChem CID8706
IUPAC Name1,3-benzothiazol-2-amine
Molecular FormulaC7H6N2S
Molecular Weight150.20
XLogP1.9
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity129
SMILES
C1=CC=C2C(=C1)N=C(S2)N
InChI
InChI=1S/C7H6N2S/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H2,8,9)
InChIKey
UHGULLIUJBCTEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzo(d)thiazol-2-amine
CAS: 136-95-8
CID: 8706
Formula: C7H6N2S
MW: 150.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.20
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass150.02516937
Monoisotopic Mass150.02516937
Topological Polar Surface Area67.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity129
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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