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688363-73-7 | 8-Bromo-2,2-dimethyl-4H-benzo[1,4]oxazin-3-one
CAS No: 688363-73-7 Catalog No: AG006GQL MDL No:MFCD09261263
Product Description
Catalog Number:
AG006GQL
Chemical Name:
8-Bromo-2,2-dimethyl-4H-benzo[1,4]oxazin-3-one
CAS Number:
688363-73-7
Molecular Formula:
C10H10BrNO2
Molecular Weight:
256.0959
MDL Number:
MFCD09261263
IUPAC Name:
8-bromo-2,2-dimethyl-4H-1,4-benzoxazin-3-one
InChI:
InChI=1S/C10H10BrNO2/c1-10(2)9(13)12-7-5-3-4-6(11)8(7)14-10/h3-5H,1-2H3,(H,12,13)
InChI Key:
ZYPVSNYNICRCNG-UHFFFAOYSA-N
SMILES:
O=C1Nc2cccc(c2OC1(C)C)Br
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.989g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.099g/mol
Monoisotopic Mass:
254.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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