Name: Name:Ethanone,1-(2-chloro-6-benzothiazolyl)-(9CI)
Brand: Angene
SKU: AG00EKCI
Rating: 90 (10 reviews)

Ethanone,1-(2-chloro-6-benzothiazolyl)-(9CI)

CAS No.:

61700-72-9

Catalog Number:

AG00EKCI

Molecular Formula:

C9H6ClNOS

Molecular Weight:

211.6680

Catalog Number:

AG00EKCI

Chemical Name:

Ethanone,1-(2-chloro-6-benzothiazolyl)-(9CI)

CAS Number:

61700-72-9

Molecular Formula:

C9H6ClNOS

Molecular Weight:

211.6680

MDL Number:

MFCD00464333

IUPAC Name:

1-(2-chloro-1,3-benzothiazol-6-yl)ethanone

InChI:

InChI=1S/C9H6ClNOS/c1-5(12)6-2-3-7-8(4-6)13-9(10)11-7/h2-4H,1H3

InChI Key:

GEKLYUQDFFSCCG-UHFFFAOYSA-N

SMILES:

Clc1nc2c(s1)cc(cc2)C(=O)C

Complexity:

224

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.986g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

211.663g/mol

Monoisotopic Mass:

210.986g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2