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842137-46-6 | 4H-1,3-Benzodioxin-4-one, 6-amino-2,2-dimethyl-
CAS No: 842137-46-6 Catalog No: AG004RWG MDL No:
Product Description
Catalog Number:
AG004RWG
Chemical Name:
4H-1,3-Benzodioxin-4-one, 6-amino-2,2-dimethyl-
CAS Number:
842137-46-6
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
IUPAC Name:
6-amino-2,2-dimethyl-1,3-benzodioxin-4-one
InChI:
InChI=1S/C10H11NO3/c1-10(2)13-8-4-3-6(11)5-7(8)9(12)14-10/h3-5H,11H2,1-2H3
InChI Key:
MRRAHVVJYAOMSB-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)C(=O)OC(O2)(C)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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