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114046-01-4 | 2H-1,4-Benzoxazin-2-one, 7-(dimethylamino)-
CAS No: 114046-01-4 Catalog No: AG000ADT MDL No:
Product Description
Catalog Number:
AG000ADT
Chemical Name:
2H-1,4-Benzoxazin-2-one, 7-(dimethylamino)-
CAS Number:
114046-01-4
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
IUPAC Name:
7-(dimethylamino)-1,4-benzoxazin-2-one
InChI:
InChI=1S/C10H10N2O2/c1-12(2)7-3-4-8-9(5-7)14-10(13)6-11-8/h3-6H,1-2H3
InChI Key:
AISSMISSWIFMBH-UHFFFAOYSA-N
SMILES:
CN(c1ccc2c(c1)oc(=O)cn2)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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