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304853-34-7 | 2H-3,1-Benzoxazine-2-thione, 6-bromo-1,4-dihydro-4,4-dimethyl-
CAS No: 304853-34-7 Catalog No: AG0030A2 MDL No:
Product Description
Catalog Number:
AG0030A2
Chemical Name:
2H-3,1-Benzoxazine-2-thione, 6-bromo-1,4-dihydro-4,4-dimethyl-
CAS Number:
304853-34-7
Molecular Formula:
C10H10BrNOS
Molecular Weight:
272.1615
IUPAC Name:
6-bromo-4,4-dimethyl-1H-3,1-benzoxazine-2-thione
InChI:
InChI=1S/C10H10BrNOS/c1-10(2)7-5-6(11)3-4-8(7)12-9(14)13-10/h3-5H,1-2H3,(H,12,14)
InChI Key:
PJJIGEUPSHUTDW-UHFFFAOYSA-N
SMILES:
S=C1Nc2ccc(cc2C(O1)(C)C)Br
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.967g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.16g/mol
Monoisotopic Mass:
270.967g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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