200,000+ products from a single source!
sales@angenechem.com
89059-25-6 | Benzothiazolium, 6-chloro-3-[2-oxo-2-(2-propenyloxy)ethyl]-, bromide
CAS No: 89059-25-6 Catalog No: AG0041CX MDL No:
Product Description
Catalog Number:
AG0041CX
Chemical Name:
Benzothiazolium, 6-chloro-3-[2-oxo-2-(2-propenyloxy)ethyl]-, bromide
CAS Number:
89059-25-6
Molecular Formula:
C12H11BrClNO2S
Molecular Weight:
348.6432
IUPAC Name:
prop-2-enyl 2-(6-chloro-1,3-benzothiazol-3-ium-3-yl)acetate;bromide
InChI:
InChI=1S/C12H11ClNO2S.BrH/c1-2-5-16-12(15)7-14-8-17-11-6-9(13)3-4-10(11)14;/h2-4,6,8H,1,5,7H2;1H/q+1;/p-1
InChI Key:
KILZDQGDGQXUCQ-UHFFFAOYSA-M
SMILES:
C=CCOC(=O)C[n+]1csc2c1ccc(c2)Cl.[Br-]
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.938g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.639g/mol
Monoisotopic Mass:
346.938g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.