200,000+ products from a single source!
sales@angenechem.com
127346-21-8 | 2(3H)-Benzothiazolimine, 6-fluoro-3-(2-propynyl)-, monohydrobromide
CAS No: 127346-21-8 Catalog No: AG01FMF7 MDL No:MFCD22587679
Product Description
Catalog Number:
AG01FMF7
Chemical Name:
2(3H)-Benzothiazolimine, 6-fluoro-3-(2-propynyl)-, monohydrobromide
CAS Number:
127346-21-8
Molecular Formula:
C10H8BrFN2S
Molecular Weight:
287.1513
MDL Number:
MFCD22587679
IUPAC Name:
6-fluoro-3-prop-2-ynyl-1,3-benzothiazol-3-ium-2-amine;bromide
InChI:
InChI=1S/C10H7FN2S.BrH/c1-2-5-13-8-4-3-7(11)6-9(8)14-10(13)12;/h1,3-4,6,12H,5H2;1H
InChI Key:
HSDGGVVJOIQJAU-UHFFFAOYSA-N
SMILES:
C#CC[n+]1c(N)sc2c1ccc(c2)F.[Br-]
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.958g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.15g/mol
Monoisotopic Mass:
285.958g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.