200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1949816-45-8
1949816-45-8 | Methyl 2-(6-ethyl-2-iminobenzo[d]thiazol-3(2H)-yl)acetate hydrobromide
CAS No: 1949816-45-8 Catalog No: AG01FMZF MDL No:MFCD26940475
Product Description
Catalog Number:
AG01FMZF
Chemical Name:
Methyl 2-(6-ethyl-2-iminobenzo[d]thiazol-3(2H)-yl)acetate hydrobromide
CAS Number:
1949816-45-8
Molecular Formula:
C12H15BrN2O2S
Molecular Weight:
331.2287
MDL Number:
MFCD26940475
IUPAC Name:
methyl 2-(6-ethyl-2-imino-1,3-benzothiazol-3-yl)acetate;hydrobromide
InChI:
InChI=1S/C12H14N2O2S.BrH/c1-3-8-4-5-9-10(6-8)17-12(13)14(9)7-11(15)16-2;/h4-6,13H,3,7H2,1-2H3;1H
InChI Key:
WVLCLNNYGRTDQE-UHFFFAOYSA-N
SMILES:
COC(=O)Cn1c(=N)sc2c1ccc(c2)CC.Br
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.004g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
331.228g/mol
Monoisotopic Mass:
330.004g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.