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Home > Bromides > 1254332-84-7
1254332-84-7 | 2H-1,4-Benzoxazine, 6-bromo-3,4-dihydro-3-methyl-
CAS No: 1254332-84-7 Catalog No: AG000NOX MDL No:
Product Description
Catalog Number:
AG000NOX
Chemical Name:
2H-1,4-Benzoxazine, 6-bromo-3,4-dihydro-3-methyl-
CAS Number:
1254332-84-7
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
IUPAC Name:
6-bromo-3-methyl-3,4-dihydro-2H-1,4-benzoxazine
InChI:
InChI=1S/C9H10BrNO/c1-6-5-12-9-3-2-7(10)4-8(9)11-6/h2-4,6,11H,5H2,1H3
InChI Key:
DAMUKFVLKNTFNK-UHFFFAOYSA-N
SMILES:
CC1COc2c(N1)cc(cc2)Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.089g/mol
Monoisotopic Mass:
226.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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