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Home > Other Building Blocks > 1244949-73-2
1244949-73-2 | 2H-1,3-Benzoxazin-2-one, 6-acetyl-3,4-dihydro-
CAS No: 1244949-73-2 Catalog No: AG000M36 MDL No:MFCD23135643
Product Description
Catalog Number:
AG000M36
Chemical Name:
2H-1,3-Benzoxazin-2-one, 6-acetyl-3,4-dihydro-
CAS Number:
1244949-73-2
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD23135643
IUPAC Name:
6-acetyl-3,4-dihydro-1,3-benzoxazin-2-one
InChI:
InChI=1S/C10H9NO3/c1-6(12)7-2-3-9-8(4-7)5-11-10(13)14-9/h2-4H,5H2,1H3,(H,11,13)
InChI Key:
KKPYYEFDNGRAEP-UHFFFAOYSA-N
SMILES:
O=C1NCc2c(O1)ccc(c2)C(=O)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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