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80644-87-7 | 1,3-Benzodioxole-5-acetamide, N,N-dimethyl-
CAS No: 80644-87-7 Catalog No: AG005KE5 MDL No:
Product Description
Catalog Number:
AG005KE5
Chemical Name:
1,3-Benzodioxole-5-acetamide, N,N-dimethyl-
CAS Number:
80644-87-7
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
IUPAC Name:
2-(1,3-benzodioxol-5-yl)-N,N-dimethylacetamide
InChI:
InChI=1S/C11H13NO3/c1-12(2)11(13)6-8-3-4-9-10(5-8)15-7-14-9/h3-5H,6-7H2,1-2H3
InChI Key:
FZPDHUFKEUTLIL-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Cc1ccc2c(c1)OCO2
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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