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141650-36-4 | 2H-1,4-Benzothiazine, 4-(2,2-diethoxyethyl)-3,4-dihydro-
CAS No: 141650-36-4 Catalog No: AG007KJ7 MDL No:
Product Description
Catalog Number:
AG007KJ7
Chemical Name:
2H-1,4-Benzothiazine, 4-(2,2-diethoxyethyl)-3,4-dihydro-
CAS Number:
141650-36-4
Molecular Formula:
C14H21NO2S
Molecular Weight:
267.3870
IUPAC Name:
4-(2,2-diethoxyethyl)-2,3-dihydro-1,4-benzothiazine
InChI:
InChI=1S/C14H21NO2S/c1-3-16-14(17-4-2)11-15-9-10-18-13-8-6-5-7-12(13)15/h5-8,14H,3-4,9-11H2,1-2H3
InChI Key:
JNGCOZZDSCZQTB-UHFFFAOYSA-N
SMILES:
CCOC(CN1CCSc2c1cccc2)OCC
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.129g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.387g/mol
Monoisotopic Mass:
267.129g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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