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77901-22-5 | 2H-1,4-Benzoxazine, 3,4-dihydro-4-methyl-
CAS No: 77901-22-5 Catalog No: AG0056VY MDL No:MFCD01651884
Product Description
Catalog Number:
AG0056VY
Chemical Name:
2H-1,4-Benzoxazine, 3,4-dihydro-4-methyl-
CAS Number:
77901-22-5
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD01651884
IUPAC Name:
4-methyl-2,3-dihydro-1,4-benzoxazine
InChI:
InChI=1S/C9H11NO/c1-10-6-7-11-9-5-3-2-4-8(9)10/h2-5H,6-7H2,1H3
InChI Key:
YJRQBOOMJGYUPI-UHFFFAOYSA-N
SMILES:
CN1CCOc2c1cccc2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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