Name: Name:methyl 4-bromo-2-chloro-1,3-benzothiazole-6-carboxylate
Brand: Angene
SKU: AG01DW0I
Rating: 90 (10 reviews)

methyl 4-bromo-2-chloro-1,3-benzothiazole-6-carboxylate

CAS No.:

1403763-71-2

Catalog Number:

AG01DW0I

Molecular Formula:

C9H5BrClNO2S

Molecular Weight:

306.5635

Catalog Number:

AG01DW0I

Chemical Name:

methyl 4-bromo-2-chloro-1,3-benzothiazole-6-carboxylate

CAS Number:

1403763-71-2

Molecular Formula:

C9H5BrClNO2S

Molecular Weight:

306.5635

MDL Number:

MFCD28967994

IUPAC Name:

methyl 4-bromo-2-chloro-1,3-benzothiazole-6-carboxylate

InChI:

InChI=1S/C9H5BrClNO2S/c1-14-8(13)4-2-5(10)7-6(3-4)15-9(11)12-7/h2-3H,1H3

InChI Key:

PHFCEUOOJPKEGR-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(Br)c2c(c1)sc(n2)Cl

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

304.891g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

306.558g/mol

Monoisotopic Mass:

304.891g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9