CAS 29927-08-0 | 5,6-Dimethylbenzo[d]thiazol-2-amine | CAS Number 29927-08-0

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29927-08-0 | 5,6-Dimethylbenzo[d]thiazol-2-amine

CAS No: 29927-08-0 Catalog No: AG003MA9 MDL No:MFCD00005790

Product Description

Catalog Number:

AG003MA9

Chemical Name:

5,6-Dimethylbenzo[d]thiazol-2-amine

CAS Number:

29927-08-0

Molecular Formula:

C9H10N2S

Molecular Weight:

178.2541

MDL Number:

MFCD00005790

IUPAC Name:

5,6-dimethyl-1,3-benzothiazol-2-amine

InChI:

InChI=1S/C9H10N2S/c1-5-3-7-8(4-6(5)2)12-9(10)11-7/h3-4H,1-2H3,(H2,10,11)

InChI Key:

IODWHFFPQHUDAG-UHFFFAOYSA-N

SMILES:

Nc1sc2c(n1)cc(c(c2)C)C

EC Number:

249-960-4

UNII:

6YBU8Z59YS

NSC Number:

140729

Properties

Complexity:

174

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.253g/mol

Monoisotopic Mass:

178.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Prediction of genotoxicity of chemical compounds by statistical learning methods.	Chemical research in toxicology 20050601