5-Aminobenzothiazole
Product Specifications
- CAS
- 1123-93-9
- MF
- C7H6N2S
- Appearance
- yellow solid
- Synonym(s)
- 5-Amino-1,3-benzothiazole; 1,3-benzothiazol-5-amine; benzo[d]thiazol-5-aMine; Benzothiazol-5-ylamino
- Shipping
- 2-8°C
- Storage
- 2-8°C
5-Aminobenzothiazole is the CAS 1123-93-9 record with formula C7H6N2S and PubChem CID 70749. Its molecular weight is 150.20. PubChem names the same structure benzothiazol-5-amine. The stored SMILES C1=CC2=C(C=C1N)N=CS2 and InChIKey UJZYHMZRXGNDFB-UHFFFAOYSA-N match that official entry and provide complementary text identifiers for the product page.
Benzothiazole is a fused system joining a benzene ring to a five-membered ring containing nitrogen and sulfur. The amino group is attached at position 5 of the benzene portion. In the SMILES, the sulfur is represented by S and the imine relation by N=C. This connection pattern explains why positional aminobenzothiazoles are distinct records even where elemental composition remains unchanged. The official synonym match is limited to the same verified graph, rather than treating a related benzothiazole name as interchangeable.
Send Rlavie the full name 5-Aminobenzothiazole, CAS 1123-93-9, and the requested quantity for an identity-focused inquiry. If a drawing is being compared, attach it as a MOL or SDF file. PubChem CID 70749, SMILES C1=CC2=C(C=C1N)N=CS2, and InChIKey UJZYHMZRXGNDFB-UHFFFAOYSA-N allow the inquiry to be checked against the defined benzothiazole graph before request-specific information is considered. The amino location at position 5 should be retained in any structure label supplied with the message. This avoids a positional aminobenzothiazole mismatch.