200,000+ products from a single source!
sales@angenechem.com
89099-36-5 | 1,2-Benzoxathiin-4-amine, N,N-diethyl-5,6,7,8-tetrahydro-, 2,2-dioxide
CAS No: 89099-36-5 Catalog No: AG003ZYH MDL No:
Product Description
Catalog Number:
AG003ZYH
Chemical Name:
1,2-Benzoxathiin-4-amine, N,N-diethyl-5,6,7,8-tetrahydro-, 2,2-dioxide
CAS Number:
89099-36-5
Molecular Formula:
C12H19NO3S
Molecular Weight:
257.3492
IUPAC Name:
N,N-diethyl-2,2-dioxo-5,6,7,8-tetrahydro-1,2λ6-benzoxathiin-4-amine
InChI:
InChI=1S/C12H19NO3S/c1-3-13(4-2)11-9-17(14,15)16-12-8-6-5-7-10(11)12/h9H,3-8H2,1-2H3
InChI Key:
ZXEOTPIUHSTJCY-UHFFFAOYSA-N
SMILES:
CCN(C1=CS(=O)(=O)OC2=C1CCCC2)CC
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.109g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.348g/mol
Monoisotopic Mass:
257.109g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.