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113947-96-9 | Benzeneacetamide, 2-bromo-N,N-bis(1-methylethyl)-
CAS No: 113947-96-9 Catalog No: AG000A5E MDL No:
Product Description
Catalog Number:
AG000A5E
Chemical Name:
Benzeneacetamide, 2-bromo-N,N-bis(1-methylethyl)-
CAS Number:
113947-96-9
Molecular Formula:
C14H20BrNO
Molecular Weight:
298.2187
IUPAC Name:
2-(2-bromophenyl)-N,N-di(propan-2-yl)acetamide
InChI:
InChI=1S/C14H20BrNO/c1-10(2)16(11(3)4)14(17)9-12-7-5-6-8-13(12)15/h5-8,10-11H,9H2,1-4H3
InChI Key:
MBBXIKGKEFSSPX-UHFFFAOYSA-N
SMILES:
CC(N(C(=O)Cc1ccccc1Br)C(C)C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.073g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.224g/mol
Monoisotopic Mass:
297.073g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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